USER MOD reduce.3.24.130724 H: found=0, std=0, add=919, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 919 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 37 CYS SG : rot 180:sc= -5.37! USER MOD Set 1.2: A 107 HIS : no HE2:sc= 1.18 K(o=-3.2,f=-13!) USER MOD Set 1.3: A 109 SER OG : rot 167:sc= 0.964 USER MOD Set 2.1: A 53 THR OG1 : rot 80:sc= 1.87 USER MOD Set 2.2: A 91 TYR OH : rot 139:sc= 1.15 USER MOD Set 2.3: A 96 SER OG : rot -28:sc= 1.05 USER MOD Set 3.1: A 69 ASN : amide:sc= 0.546 K(o=0.3,f=-0.78) USER MOD Set 3.2: A 73 SER OG : rot 27:sc= -0.0347 USER MOD Set 3.3: A 75 SER OG : rot 111:sc= -0.208 USER MOD Set 4.1: A 35 THR OG1 : rot 110:sc= -0.32 USER MOD Set 4.2: A 79 GLN : amide:sc= -2.16! X(o=-2.5!,f=-2.6) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -128:sc= 0.0202 (180deg=-0.117) USER MOD Single : A 3 HIS : no HD1:sc= -0.298 X(o=-0.3,f=-0.24) USER MOD Single : A 4 HIS : no HD1:sc= -0.413 X(o=-0.41,f=0.038) USER MOD Single : A 5 HIS : no HE2:sc= 0.677 K(o=0.68,f=-2.4!) USER MOD Single : A 6 HIS : no HD1:sc= -0.0851 X(o=-0.085,f=0) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.0286 X(o=-0.029,f=0) USER MOD Single : A 9 MET CE :methyl 163:sc= -0.0804 (180deg=-0.518) USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.196 USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 MET CE :methyl -164:sc= -0.0723 (180deg=-0.431) USER MOD Single : A 23 GLN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 25 SER OG : rot 180:sc= 0.018 USER MOD Single : A 26 MET CE :methyl 156:sc= -0.269 (180deg=-1) USER MOD Single : A 28 SER OG : rot 180:sc= 0.0161 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 120:sc= -0.0688 USER MOD Single : A 38 TYR OH : rot 125:sc= -0.528 USER MOD Single : A 41 THR OG1 : rot -170:sc= 0.146 USER MOD Single : A 43 LYS NZ :NH3+ -171:sc= -0.0129 (180deg=-0.0948) USER MOD Single : A 45 GLN : amide:sc= -1.44! C(o=-1.4!,f=-3.3!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -169:sc= -0.106 (180deg=-0.303) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 TYR OH : rot 30:sc= 0 USER MOD Single : A 67 THR OG1 : rot 163:sc= -2.73! USER MOD Single : A 68 ASN :FLIP amide:sc= -0.377 F(o=-1.7!,f=-0.38) USER MOD Single : A 82 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00476) USER MOD Single : A 84 GLN : amide:sc= -1.15 K(o=-1.1,f=-2.9) USER MOD Single : A 90 LYS NZ :NH3+ 166:sc= 0.561 (180deg=0.308) USER MOD Single : A 93 HIS : no HD1:sc= -0.372 X(o=-0.37,f=-0.48) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ -137:sc= -0.0782 (180deg=-0.455) USER MOD Single : A 99 SER OG : rot 52:sc= 1.1 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ -135:sc= -1.76! (180deg=-4.49!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 59.659-146.752 -23.687 1.00 52.12 N ATOM 2 CA MET A 1 60.118-147.946 -22.947 1.00 51.22 C ATOM 3 C MET A 1 59.086-148.345 -21.901 1.00 31.51 C ATOM 4 O MET A 1 58.346-147.491 -21.403 1.00 43.23 O ATOM 5 CB MET A 1 61.472-147.671 -22.278 1.00 33.04 C ATOM 6 CG MET A 1 62.592-147.352 -23.261 1.00 72.33 C ATOM 7 SD MET A 1 62.889-148.691 -24.439 1.00 4.50 S ATOM 8 CE MET A 1 64.204-147.984 -25.437 1.00 20.10 C ATOM 0 H1 MET A 1 59.707-146.937 -24.709 1.00 52.12 H new ATOM 0 H2 MET A 1 58.678-146.534 -23.420 1.00 52.12 H new ATOM 0 H3 MET A 1 60.269-145.943 -23.453 1.00 52.12 H new ATOM 0 HA MET A 1 60.239-148.768 -23.652 1.00 51.22 H new ATOM 0 HB2 MET A 1 61.361-146.837 -21.585 1.00 33.04 H new ATOM 0 HB3 MET A 1 61.758-148.541 -21.687 1.00 33.04 H new ATOM 0 HG2 MET A 1 62.343-146.442 -23.807 1.00 72.33 H new ATOM 0 HG3 MET A 1 63.509-147.150 -22.708 1.00 72.33 H new ATOM 0 HE1 MET A 1 64.496-148.695 -26.210 1.00 20.10 H new ATOM 0 HE2 MET A 1 63.852-147.064 -25.904 1.00 20.10 H new ATOM 0 HE3 MET A 1 65.063-147.764 -24.803 1.00 20.10 H new ATOM 20 N ALA A 2 59.048-149.640 -21.582 1.00 23.30 N ATOM 21 CA ALA A 2 58.108-150.196 -20.607 1.00 11.25 C ATOM 22 C ALA A 2 56.689-150.257 -21.177 1.00 62.11 C ATOM 23 O ALA A 2 56.106-149.238 -21.555 1.00 12.45 O ATOM 24 CB ALA A 2 58.132-149.410 -19.298 1.00 63.04 C ATOM 0 H ALA A 2 59.670-150.335 -21.994 1.00 23.30 H new ATOM 0 HA ALA A 2 58.429-151.215 -20.391 1.00 11.25 H new ATOM 0 HB1 ALA A 2 57.423-149.849 -18.597 1.00 63.04 H new ATOM 0 HB2 ALA A 2 59.134-149.445 -18.871 1.00 63.04 H new ATOM 0 HB3 ALA A 2 57.856-148.373 -19.491 1.00 63.04 H new ATOM 30 N HIS A 3 56.135-151.461 -21.216 1.00 20.45 N ATOM 31 CA HIS A 3 54.796-151.700 -21.751 1.00 41.31 C ATOM 32 C HIS A 3 53.764-151.618 -20.616 1.00 14.54 C ATOM 33 O HIS A 3 52.738-152.310 -20.628 1.00 61.24 O ATOM 34 CB HIS A 3 54.767-153.080 -22.434 1.00 23.32 C ATOM 35 CG HIS A 3 53.516-153.379 -23.213 1.00 30.41 C ATOM 36 ND1 HIS A 3 53.192-154.644 -23.652 1.00 73.03 N ATOM 37 CD2 HIS A 3 52.510-152.573 -23.630 1.00 73.32 C ATOM 38 CE1 HIS A 3 52.048-154.605 -24.305 1.00 11.32 C ATOM 39 NE2 HIS A 3 51.610-153.360 -24.304 1.00 30.43 N ATOM 0 H HIS A 3 56.600-152.303 -20.877 1.00 20.45 H new ATOM 0 HA HIS A 3 54.544-150.940 -22.491 1.00 41.31 H new ATOM 0 HB2 HIS A 3 55.622-153.154 -23.106 1.00 23.32 H new ATOM 0 HB3 HIS A 3 54.894-153.848 -21.672 1.00 23.32 H new ATOM 0 HD2 HIS A 3 52.431-151.509 -23.463 1.00 73.32 H new ATOM 0 HE1 HIS A 3 51.553-155.448 -24.763 1.00 11.32 H new ATOM 0 HE2 HIS A 3 50.744-153.036 -24.734 1.00 30.43 H new ATOM 48 N HIS A 4 54.052-150.754 -19.643 1.00 51.22 N ATOM 49 CA HIS A 4 53.170-150.536 -18.495 1.00 51.34 C ATOM 50 C HIS A 4 51.762-150.163 -18.958 1.00 0.14 C ATOM 51 O HIS A 4 51.594-149.470 -19.964 1.00 74.33 O ATOM 52 CB HIS A 4 53.736-149.439 -17.575 1.00 24.43 C ATOM 53 CG HIS A 4 53.777-148.066 -18.188 1.00 72.12 C ATOM 54 ND1 HIS A 4 53.342-146.937 -17.529 1.00 51.04 N ATOM 55 CD2 HIS A 4 54.223-147.642 -19.395 1.00 71.54 C ATOM 56 CE1 HIS A 4 53.516-145.882 -18.302 1.00 1.32 C ATOM 57 NE2 HIS A 4 54.049-146.280 -19.440 1.00 72.33 N ATOM 0 H HIS A 4 54.900-150.187 -19.627 1.00 51.22 H new ATOM 0 HA HIS A 4 53.114-151.467 -17.931 1.00 51.34 H new ATOM 0 HB2 HIS A 4 53.135-149.399 -16.667 1.00 24.43 H new ATOM 0 HB3 HIS A 4 54.746-149.719 -17.276 1.00 24.43 H new ATOM 0 HD2 HIS A 4 54.638-148.260 -20.177 1.00 71.54 H new ATOM 0 HE1 HIS A 4 53.264-144.864 -18.045 1.00 1.32 H new ATOM 0 HE2 HIS A 4 54.292-145.676 -20.225 1.00 72.33 H new ATOM 66 N HIS A 5 50.757-150.619 -18.221 1.00 1.20 N ATOM 67 CA HIS A 5 49.362-150.454 -18.622 1.00 3.11 C ATOM 68 C HIS A 5 48.460-150.288 -17.404 1.00 72.12 C ATOM 69 O HIS A 5 48.679-150.915 -16.368 1.00 25.44 O ATOM 70 CB HIS A 5 48.913-151.652 -19.472 1.00 71.20 C ATOM 71 CG HIS A 5 49.296-152.982 -18.890 1.00 35.25 C ATOM 72 ND1 HIS A 5 50.529-153.561 -19.099 1.00 61.31 N ATOM 73 CD2 HIS A 5 48.609-153.844 -18.100 1.00 64.31 C ATOM 74 CE1 HIS A 5 50.586-154.716 -18.466 1.00 14.53 C ATOM 75 NE2 HIS A 5 49.436-154.912 -17.854 1.00 10.22 N ATOM 0 H HIS A 5 50.882-151.110 -17.336 1.00 1.20 H new ATOM 0 HA HIS A 5 49.280-149.548 -19.223 1.00 3.11 H new ATOM 0 HB2 HIS A 5 47.830-151.616 -19.592 1.00 71.20 H new ATOM 0 HB3 HIS A 5 49.347-151.563 -20.468 1.00 71.20 H new ATOM 0 HD1 HIS A 5 51.281-153.158 -19.657 1.00 61.31 H new ATOM 0 HD2 HIS A 5 47.601-153.715 -17.733 1.00 64.31 H new ATOM 0 HE1 HIS A 5 51.432-155.387 -18.452 1.00 14.53 H new ATOM 84 N HIS A 6 47.439-149.446 -17.546 1.00 74.41 N ATOM 85 CA HIS A 6 46.528-149.124 -16.447 1.00 62.44 C ATOM 86 C HIS A 6 45.098-149.019 -16.971 1.00 42.35 C ATOM 87 O HIS A 6 44.895-148.814 -18.169 1.00 32.12 O ATOM 88 CB HIS A 6 46.943-147.801 -15.781 1.00 4.33 C ATOM 89 CG HIS A 6 46.716-146.586 -16.641 1.00 54.12 C ATOM 90 ND1 HIS A 6 46.064-145.455 -16.196 1.00 25.22 N ATOM 91 CD2 HIS A 6 47.059-146.329 -17.928 1.00 51.05 C ATOM 92 CE1 HIS A 6 46.012-144.566 -17.170 1.00 34.00 C ATOM 93 NE2 HIS A 6 46.609-145.070 -18.232 1.00 2.42 N ATOM 0 H HIS A 6 47.219-148.969 -18.421 1.00 74.41 H new ATOM 0 HA HIS A 6 46.578-149.920 -15.704 1.00 62.44 H new ATOM 0 HB2 HIS A 6 46.387-147.684 -14.851 1.00 4.33 H new ATOM 0 HB3 HIS A 6 47.999-147.855 -15.517 1.00 4.33 H new ATOM 0 HD2 HIS A 6 47.590-146.995 -18.592 1.00 51.05 H new ATOM 0 HE1 HIS A 6 45.556-143.589 -17.108 1.00 34.00 H new ATOM 0 HE2 HIS A 6 46.718-144.601 -19.131 1.00 2.42 H new ATOM 102 N HIS A 7 44.120-149.150 -16.078 1.00 3.41 N ATOM 103 CA HIS A 7 42.712-149.061 -16.457 1.00 22.42 C ATOM 104 C HIS A 7 41.830-149.052 -15.211 1.00 74.24 C ATOM 105 O HIS A 7 42.269-149.436 -14.124 1.00 22.25 O ATOM 106 CB HIS A 7 42.306-150.228 -17.374 1.00 14.31 C ATOM 107 CG HIS A 7 42.323-151.567 -16.700 1.00 52.42 C ATOM 108 ND1 HIS A 7 41.177-152.222 -16.299 1.00 2.02 N ATOM 109 CD2 HIS A 7 43.353-152.378 -16.362 1.00 55.24 C ATOM 110 CE1 HIS A 7 41.503-153.375 -15.745 1.00 30.14 C ATOM 111 NE2 HIS A 7 42.816-153.493 -15.772 1.00 45.03 N ATOM 0 H HIS A 7 44.277-149.319 -15.084 1.00 3.41 H new ATOM 0 HA HIS A 7 42.572-148.130 -17.006 1.00 22.42 H new ATOM 0 HB2 HIS A 7 41.305-150.041 -17.762 1.00 14.31 H new ATOM 0 HB3 HIS A 7 42.980-150.255 -18.230 1.00 14.31 H new ATOM 0 HD2 HIS A 7 44.402-152.183 -16.527 1.00 55.24 H new ATOM 0 HE1 HIS A 7 40.812-154.099 -15.339 1.00 30.14 H new ATOM 0 HE2 HIS A 7 43.347-154.286 -15.412 1.00 45.03 H new ATOM 120 N HIS A 8 40.587-148.619 -15.379 1.00 1.42 N ATOM 121 CA HIS A 8 39.626-148.557 -14.282 1.00 40.41 C ATOM 122 C HIS A 8 38.230-148.310 -14.836 1.00 31.21 C ATOM 123 O HIS A 8 38.082-147.785 -15.941 1.00 1.54 O ATOM 124 CB HIS A 8 39.993-147.440 -13.291 1.00 5.14 C ATOM 125 CG HIS A 8 39.887-146.056 -13.867 1.00 51.02 C ATOM 126 ND1 HIS A 8 40.938-145.416 -14.486 1.00 43.10 N ATOM 127 CD2 HIS A 8 38.842-145.193 -13.927 1.00 71.51 C ATOM 128 CE1 HIS A 8 40.547-144.224 -14.896 1.00 10.51 C ATOM 129 NE2 HIS A 8 39.280-144.065 -14.570 1.00 62.52 N ATOM 0 H HIS A 8 40.216-148.302 -16.275 1.00 1.42 H new ATOM 0 HA HIS A 8 39.649-149.509 -13.752 1.00 40.41 H new ATOM 0 HB2 HIS A 8 39.341-147.512 -12.420 1.00 5.14 H new ATOM 0 HB3 HIS A 8 41.012-147.600 -12.940 1.00 5.14 H new ATOM 0 HD2 HIS A 8 37.848-145.364 -13.540 1.00 71.51 H new ATOM 0 HE1 HIS A 8 41.162-143.501 -15.412 1.00 10.51 H new ATOM 0 HE2 HIS A 8 38.717-143.237 -14.765 1.00 62.52 H new ATOM 138 N MET A 9 37.216-148.681 -14.067 1.00 32.43 N ATOM 139 CA MET A 9 35.829-148.413 -14.432 1.00 63.23 C ATOM 140 C MET A 9 35.039-148.020 -13.189 1.00 31.31 C ATOM 141 O MET A 9 34.598-148.880 -12.424 1.00 61.42 O ATOM 142 CB MET A 9 35.193-149.636 -15.115 1.00 35.41 C ATOM 143 CG MET A 9 33.766-149.401 -15.602 1.00 51.11 C ATOM 144 SD MET A 9 33.087-150.820 -16.490 1.00 3.44 S ATOM 145 CE MET A 9 33.124-152.081 -15.212 1.00 24.31 C ATOM 0 H MET A 9 37.328-149.172 -13.180 1.00 32.43 H new ATOM 0 HA MET A 9 35.807-147.588 -15.144 1.00 63.23 H new ATOM 0 HB2 MET A 9 35.812-149.929 -15.963 1.00 35.41 H new ATOM 0 HB3 MET A 9 35.195-150.472 -14.416 1.00 35.41 H new ATOM 0 HG2 MET A 9 33.128-149.174 -14.748 1.00 51.11 H new ATOM 0 HG3 MET A 9 33.749-148.528 -16.254 1.00 51.11 H new ATOM 0 HE1 MET A 9 32.474-152.908 -15.498 1.00 24.31 H new ATOM 0 HE2 MET A 9 34.144-152.446 -15.091 1.00 24.31 H new ATOM 0 HE3 MET A 9 32.777-151.655 -14.271 1.00 24.31 H new ATOM 155 N GLY A 10 34.889-146.716 -12.980 1.00 41.12 N ATOM 156 CA GLY A 10 34.200-146.211 -11.804 1.00 0.44 C ATOM 157 C GLY A 10 33.212-145.116 -12.155 1.00 11.55 C ATOM 158 O GLY A 10 33.600-143.963 -12.361 1.00 74.43 O ATOM 0 H GLY A 10 35.236-145.993 -13.610 1.00 41.12 H new ATOM 0 HA2 GLY A 10 33.675-147.029 -11.311 1.00 0.44 H new ATOM 0 HA3 GLY A 10 34.931-145.826 -11.092 1.00 0.44 H new ATOM 162 N THR A 11 31.940-145.482 -12.239 1.00 73.24 N ATOM 163 CA THR A 11 30.877-144.549 -12.594 1.00 53.21 C ATOM 164 C THR A 11 29.784-144.547 -11.538 1.00 62.12 C ATOM 165 O THR A 11 29.650-145.506 -10.765 1.00 32.23 O ATOM 166 CB THR A 11 30.277-144.878 -13.977 1.00 24.22 C ATOM 167 OG1 THR A 11 29.024-144.208 -14.183 1.00 5.43 O ATOM 168 CG2 THR A 11 30.103-146.372 -14.130 1.00 21.21 C ATOM 0 H THR A 11 31.615-146.433 -12.063 1.00 73.24 H new ATOM 0 HA THR A 11 31.320-143.554 -12.643 1.00 53.21 H new ATOM 0 HB THR A 11 30.974-144.519 -14.735 1.00 24.22 H new ATOM 0 HG1 THR A 11 28.672-144.437 -15.069 1.00 5.43 H new ATOM 0 HG21 THR A 11 29.679-146.590 -15.110 1.00 21.21 H new ATOM 0 HG22 THR A 11 31.072-146.863 -14.036 1.00 21.21 H new ATOM 0 HG23 THR A 11 29.433-146.742 -13.354 1.00 21.21 H new ATOM 176 N LEU A 12 29.010-143.469 -11.516 1.00 73.43 N ATOM 177 CA LEU A 12 27.953-143.289 -10.526 1.00 60.44 C ATOM 178 C LEU A 12 27.170-142.004 -10.799 1.00 2.34 C ATOM 179 O LEU A 12 27.730-141.014 -11.273 1.00 43.41 O ATOM 180 CB LEU A 12 28.542-143.246 -9.104 1.00 50.00 C ATOM 181 CG LEU A 12 27.513-143.162 -7.961 1.00 32.44 C ATOM 182 CD1 LEU A 12 26.619-144.401 -7.938 1.00 40.14 C ATOM 183 CD2 LEU A 12 28.217-142.973 -6.619 1.00 54.24 C ATOM 0 H LEU A 12 29.095-142.699 -12.179 1.00 73.43 H new ATOM 0 HA LEU A 12 27.274-144.139 -10.602 1.00 60.44 H new ATOM 0 HB2 LEU A 12 29.152-144.137 -8.955 1.00 50.00 H new ATOM 0 HB3 LEU A 12 29.209-142.387 -9.032 1.00 50.00 H new ATOM 0 HG LEU A 12 26.877-142.295 -8.138 1.00 32.44 H new ATOM 0 HD11 LEU A 12 25.901-144.317 -7.122 1.00 40.14 H new ATOM 0 HD12 LEU A 12 26.084-144.482 -8.884 1.00 40.14 H new ATOM 0 HD13 LEU A 12 27.233-145.290 -7.791 1.00 40.14 H new ATOM 0 HD21 LEU A 12 27.474-142.916 -5.823 1.00 54.24 H new ATOM 0 HD22 LEU A 12 28.882-143.817 -6.435 1.00 54.24 H new ATOM 0 HD23 LEU A 12 28.798-142.051 -6.640 1.00 54.24 H new ATOM 195 N GLU A 13 25.876-142.043 -10.508 1.00 52.03 N ATOM 196 CA GLU A 13 25.007-140.878 -10.611 1.00 22.25 C ATOM 197 C GLU A 13 23.858-141.041 -9.615 1.00 62.32 C ATOM 198 O GLU A 13 23.066-141.979 -9.722 1.00 2.42 O ATOM 199 CB GLU A 13 24.488-140.729 -12.052 1.00 51.21 C ATOM 200 CG GLU A 13 23.592-139.516 -12.281 1.00 55.21 C ATOM 201 CD GLU A 13 24.209-138.213 -11.789 1.00 31.33 C ATOM 202 OE1 GLU A 13 25.153-137.710 -12.432 1.00 54.41 O ATOM 203 OE2 GLU A 13 23.741-137.684 -10.759 1.00 45.33 O ATOM 0 H GLU A 13 25.398-142.887 -10.193 1.00 52.03 H new ATOM 0 HA GLU A 13 25.559-139.970 -10.370 1.00 22.25 H new ATOM 0 HB2 GLU A 13 25.341-140.667 -12.727 1.00 51.21 H new ATOM 0 HB3 GLU A 13 23.935-141.629 -12.320 1.00 51.21 H new ATOM 0 HG2 GLU A 13 23.375-139.429 -13.346 1.00 55.21 H new ATOM 0 HG3 GLU A 13 22.640-139.674 -11.774 1.00 55.21 H new ATOM 210 N ALA A 14 23.771-140.131 -8.646 1.00 75.13 N ATOM 211 CA ALA A 14 22.858-140.294 -7.513 1.00 74.41 C ATOM 212 C ALA A 14 22.216-138.964 -7.116 1.00 5.34 C ATOM 213 O ALA A 14 22.390-137.954 -7.799 1.00 31.41 O ATOM 214 CB ALA A 14 23.607-140.910 -6.334 1.00 21.45 C ATOM 0 H ALA A 14 24.321-139.273 -8.622 1.00 75.13 H new ATOM 0 HA ALA A 14 22.052-140.964 -7.813 1.00 74.41 H new ATOM 0 HB1 ALA A 14 22.925-141.030 -5.492 1.00 21.45 H new ATOM 0 HB2 ALA A 14 24.002-141.884 -6.623 1.00 21.45 H new ATOM 0 HB3 ALA A 14 24.430-140.256 -6.044 1.00 21.45 H new ATOM 220 N GLN A 15 21.481-138.971 -6.004 1.00 73.23 N ATOM 221 CA GLN A 15 20.727-137.798 -5.557 1.00 10.44 C ATOM 222 C GLN A 15 21.370-137.163 -4.323 1.00 33.22 C ATOM 223 O GLN A 15 22.197-137.786 -3.648 1.00 53.33 O ATOM 224 CB GLN A 15 19.278-138.203 -5.243 1.00 53.15 C ATOM 225 CG GLN A 15 19.149-139.165 -4.062 1.00 42.52 C ATOM 226 CD GLN A 15 17.725-139.643 -3.835 1.00 12.50 C ATOM 227 OE1 GLN A 15 16.940-139.768 -4.775 1.00 73.33 O ATOM 228 NE2 GLN A 15 17.377-139.918 -2.587 1.00 64.32 N ATOM 0 H GLN A 15 21.391-139.782 -5.392 1.00 73.23 H new ATOM 0 HA GLN A 15 20.735-137.060 -6.359 1.00 10.44 H new ATOM 0 HB2 GLN A 15 18.697-137.305 -5.033 1.00 53.15 H new ATOM 0 HB3 GLN A 15 18.840-138.667 -6.127 1.00 53.15 H new ATOM 0 HG2 GLN A 15 19.793-140.028 -4.232 1.00 42.52 H new ATOM 0 HG3 GLN A 15 19.509-138.672 -3.159 1.00 42.52 H new ATOM 0 HE21 GLN A 15 18.053-139.803 -1.832 1.00 64.32 H new ATOM 0 HE22 GLN A 15 16.433-140.245 -2.381 1.00 64.32 H new ATOM 237 N THR A 16 21.007-135.914 -4.051 1.00 2.53 N ATOM 238 CA THR A 16 21.429-135.221 -2.841 1.00 64.02 C ATOM 239 C THR A 16 20.271-134.375 -2.312 1.00 10.20 C ATOM 240 O THR A 16 20.065-133.239 -2.744 1.00 24.02 O ATOM 241 CB THR A 16 22.661-134.319 -3.101 1.00 64.03 C ATOM 242 OG1 THR A 16 23.718-135.091 -3.695 1.00 72.31 O ATOM 243 CG2 THR A 16 23.164-133.676 -1.808 1.00 44.12 C ATOM 0 H THR A 16 20.413-135.355 -4.663 1.00 2.53 H new ATOM 0 HA THR A 16 21.714-135.969 -2.102 1.00 64.02 H new ATOM 0 HB THR A 16 22.356-133.525 -3.783 1.00 64.03 H new ATOM 0 HG1 THR A 16 24.493-134.514 -3.858 1.00 72.31 H new ATOM 0 HG21 THR A 16 24.029-133.050 -2.026 1.00 44.12 H new ATOM 0 HG22 THR A 16 22.373-133.064 -1.374 1.00 44.12 H new ATOM 0 HG23 THR A 16 23.449-134.455 -1.101 1.00 44.12 H new ATOM 251 N GLN A 17 19.492-134.957 -1.409 1.00 71.03 N ATOM 252 CA GLN A 17 18.308-134.296 -0.864 1.00 43.41 C ATOM 253 C GLN A 17 18.580-133.805 0.556 1.00 71.34 C ATOM 254 O GLN A 17 19.276-134.473 1.330 1.00 24.31 O ATOM 255 CB GLN A 17 17.119-135.265 -0.863 1.00 10.42 C ATOM 256 CG GLN A 17 15.799-134.622 -0.445 1.00 13.32 C ATOM 257 CD GLN A 17 14.676-135.628 -0.281 1.00 52.11 C ATOM 258 OE1 GLN A 17 14.465-136.163 0.809 1.00 64.41 O ATOM 259 NE2 GLN A 17 13.958-135.906 -1.357 1.00 14.45 N ATOM 0 H GLN A 17 19.659-135.891 -1.035 1.00 71.03 H new ATOM 0 HA GLN A 17 18.068-133.438 -1.492 1.00 43.41 H new ATOM 0 HB2 GLN A 17 17.006-135.688 -1.861 1.00 10.42 H new ATOM 0 HB3 GLN A 17 17.338-136.093 -0.189 1.00 10.42 H new ATOM 0 HG2 GLN A 17 15.942-134.089 0.495 1.00 13.32 H new ATOM 0 HG3 GLN A 17 15.510-133.881 -1.190 1.00 13.32 H new ATOM 0 HE21 GLN A 17 14.164-135.442 -2.242 1.00 14.45 H new ATOM 0 HE22 GLN A 17 13.199-136.585 -1.302 1.00 14.45 H new ATOM 268 N GLY A 18 18.029-132.643 0.896 1.00 1.13 N ATOM 269 CA GLY A 18 18.206-132.085 2.226 1.00 52.34 C ATOM 270 C GLY A 18 18.433-130.587 2.185 1.00 34.32 C ATOM 271 O GLY A 18 19.297-130.116 1.442 1.00 71.43 O ATOM 0 H GLY A 18 17.459-132.074 0.269 1.00 1.13 H new ATOM 0 HA2 GLY A 18 17.326-132.302 2.831 1.00 52.34 H new ATOM 0 HA3 GLY A 18 19.054-132.567 2.712 1.00 52.34 H new ATOM 275 N PRO A 19 17.665-129.805 2.963 1.00 11.21 N ATOM 276 CA PRO A 19 17.827-128.362 3.042 1.00 44.43 C ATOM 277 C PRO A 19 18.787-127.975 4.168 1.00 61.53 C ATOM 278 O PRO A 19 19.632-128.775 4.573 1.00 33.10 O ATOM 279 CB PRO A 19 16.397-127.897 3.337 1.00 34.13 C ATOM 280 CG PRO A 19 15.780-129.007 4.134 1.00 11.35 C ATOM 281 CD PRO A 19 16.575-130.264 3.845 1.00 74.15 C ATOM 0 HA PRO A 19 18.255-127.915 2.145 1.00 44.43 H new ATOM 0 HB2 PRO A 19 16.395-126.962 3.897 1.00 34.13 H new ATOM 0 HB3 PRO A 19 15.843-127.719 2.416 1.00 34.13 H new ATOM 0 HG2 PRO A 19 15.802-128.774 5.199 1.00 11.35 H new ATOM 0 HG3 PRO A 19 14.734-129.142 3.859 1.00 11.35 H new ATOM 0 HD2 PRO A 19 16.964-130.709 4.761 1.00 74.15 H new ATOM 0 HD3 PRO A 19 15.960-131.021 3.358 1.00 74.15 H new ATOM 289 N GLY A 20 18.649-126.758 4.673 1.00 53.25 N ATOM 290 CA GLY A 20 19.523-126.286 5.733 1.00 63.03 C ATOM 291 C GLY A 20 19.387-124.795 5.973 1.00 10.53 C ATOM 292 O GLY A 20 18.355-124.201 5.655 1.00 74.25 O ATOM 0 H GLY A 20 17.946-126.085 4.368 1.00 53.25 H new ATOM 0 HA2 GLY A 20 19.295-126.822 6.654 1.00 63.03 H new ATOM 0 HA3 GLY A 20 20.557-126.517 5.478 1.00 63.03 H new ATOM 296 N SER A 21 20.421-124.191 6.544 1.00 73.15 N ATOM 297 CA SER A 21 20.434-122.757 6.801 1.00 14.22 C ATOM 298 C SER A 21 21.837-122.195 6.564 1.00 10.43 C ATOM 299 O SER A 21 22.757-122.448 7.344 1.00 10.21 O ATOM 300 CB SER A 21 19.980-122.472 8.243 1.00 12.32 C ATOM 301 OG SER A 21 19.823-121.078 8.476 1.00 22.03 O ATOM 0 H SER A 21 21.268-124.677 6.840 1.00 73.15 H new ATOM 0 HA SER A 21 19.741-122.269 6.116 1.00 14.22 H new ATOM 0 HB2 SER A 21 19.036-122.982 8.436 1.00 12.32 H new ATOM 0 HB3 SER A 21 20.711-122.878 8.942 1.00 12.32 H new ATOM 0 HG SER A 21 19.532-120.932 9.400 1.00 22.03 H new ATOM 307 N MET A 22 22.000-121.457 5.466 1.00 63.14 N ATOM 308 CA MET A 22 23.281-120.839 5.138 1.00 73.31 C ATOM 309 C MET A 22 23.245-119.356 5.492 1.00 20.42 C ATOM 310 O MET A 22 22.882-118.515 4.665 1.00 43.13 O ATOM 311 CB MET A 22 23.614-121.023 3.648 1.00 54.34 C ATOM 312 CG MET A 22 23.763-122.480 3.221 1.00 52.42 C ATOM 313 SD MET A 22 25.058-123.347 4.133 1.00 3.25 S ATOM 314 CE MET A 22 26.513-122.407 3.658 1.00 22.13 C ATOM 0 H MET A 22 21.259-121.274 4.789 1.00 63.14 H new ATOM 0 HA MET A 22 24.061-121.328 5.721 1.00 73.31 H new ATOM 0 HB2 MET A 22 22.829-120.558 3.051 1.00 54.34 H new ATOM 0 HB3 MET A 22 24.540-120.493 3.425 1.00 54.34 H new ATOM 0 HG2 MET A 22 22.814-122.996 3.368 1.00 52.42 H new ATOM 0 HG3 MET A 22 23.986-122.520 2.155 1.00 52.42 H new ATOM 0 HE1 MET A 22 27.410-122.977 3.902 1.00 22.13 H new ATOM 0 HE2 MET A 22 26.487-122.213 2.586 1.00 22.13 H new ATOM 0 HE3 MET A 22 26.527-121.460 4.198 1.00 22.13 H new ATOM 324 N GLN A 23 23.591-119.045 6.736 1.00 42.32 N ATOM 325 CA GLN A 23 23.571-117.671 7.220 1.00 71.32 C ATOM 326 C GLN A 23 24.922-117.009 6.967 1.00 74.11 C ATOM 327 O GLN A 23 25.782-116.950 7.852 1.00 61.22 O ATOM 328 CB GLN A 23 23.225-117.638 8.713 1.00 23.42 C ATOM 329 CG GLN A 23 21.920-118.352 9.053 1.00 73.31 C ATOM 330 CD GLN A 23 21.605-118.324 10.538 1.00 45.10 C ATOM 331 OE1 GLN A 23 22.505-118.275 11.375 1.00 2.12 O ATOM 332 NE2 GLN A 23 20.325-118.358 10.873 1.00 73.02 N ATOM 0 H GLN A 23 23.890-119.730 7.430 1.00 42.32 H new ATOM 0 HA GLN A 23 22.805-117.116 6.679 1.00 71.32 H new ATOM 0 HB2 GLN A 23 24.038-118.097 9.276 1.00 23.42 H new ATOM 0 HB3 GLN A 23 23.157-116.600 9.039 1.00 23.42 H new ATOM 0 HG2 GLN A 23 21.102-117.886 8.504 1.00 73.31 H new ATOM 0 HG3 GLN A 23 21.980-119.388 8.718 1.00 73.31 H new ATOM 0 HE21 GLN A 23 19.609-118.398 10.148 1.00 73.02 H new ATOM 0 HE22 GLN A 23 20.055-118.344 11.856 1.00 73.02 H new ATOM 341 N GLY A 24 25.111-116.542 5.739 1.00 4.42 N ATOM 342 CA GLY A 24 26.372-115.937 5.349 1.00 12.50 C ATOM 343 C GLY A 24 26.473-114.480 5.755 1.00 71.41 C ATOM 344 O GLY A 24 25.542-113.922 6.347 1.00 61.51 O ATOM 0 H GLY A 24 24.408-116.572 5.001 1.00 4.42 H new ATOM 0 HA2 GLY A 24 27.193-116.494 5.802 1.00 12.50 H new ATOM 0 HA3 GLY A 24 26.490-116.018 4.268 1.00 12.50 H new ATOM 348 N SER A 25 27.610-113.872 5.449 1.00 41.01 N ATOM 349 CA SER A 25 27.841-112.463 5.728 1.00 14.24 C ATOM 350 C SER A 25 27.463-111.615 4.514 1.00 14.43 C ATOM 351 O SER A 25 27.540-112.082 3.373 1.00 11.33 O ATOM 352 CB SER A 25 29.310-112.259 6.100 1.00 34.44 C ATOM 353 OG SER A 25 30.158-112.894 5.160 1.00 60.00 O ATOM 0 H SER A 25 28.397-114.341 5.001 1.00 41.01 H new ATOM 0 HA SER A 25 27.217-112.148 6.564 1.00 14.24 H new ATOM 0 HB2 SER A 25 29.536-111.193 6.139 1.00 34.44 H new ATOM 0 HB3 SER A 25 29.497-112.661 7.096 1.00 34.44 H new ATOM 0 HG SER A 25 31.094-112.751 5.414 1.00 60.00 H new ATOM 359 N MET A 26 27.040-110.380 4.762 1.00 62.34 N ATOM 360 CA MET A 26 26.612-109.483 3.693 1.00 2.51 C ATOM 361 C MET A 26 27.675-108.420 3.414 1.00 11.11 C ATOM 362 O MET A 26 28.004-107.624 4.295 1.00 5.31 O ATOM 363 CB MET A 26 25.286-108.798 4.060 1.00 50.04 C ATOM 364 CG MET A 26 24.110-109.754 4.200 1.00 55.43 C ATOM 365 SD MET A 26 22.551-108.905 4.536 1.00 2.11 S ATOM 366 CE MET A 26 22.423-107.845 3.095 1.00 34.05 C ATOM 0 H MET A 26 26.984-109.976 5.697 1.00 62.34 H new ATOM 0 HA MET A 26 26.469-110.083 2.794 1.00 2.51 H new ATOM 0 HB2 MET A 26 25.416-108.259 4.998 1.00 50.04 H new ATOM 0 HB3 MET A 26 25.049-108.057 3.297 1.00 50.04 H new ATOM 0 HG2 MET A 26 24.011-110.337 3.284 1.00 55.43 H new ATOM 0 HG3 MET A 26 24.315-110.459 5.006 1.00 55.43 H new ATOM 0 HE1 MET A 26 21.378-107.589 2.924 1.00 34.05 H new ATOM 0 HE2 MET A 26 22.997-106.934 3.261 1.00 34.05 H new ATOM 0 HE3 MET A 26 22.816-108.367 2.223 1.00 34.05 H new ATOM 376 N PRO A 27 28.237-108.406 2.187 1.00 74.34 N ATOM 377 CA PRO A 27 29.178-107.370 1.757 1.00 71.44 C ATOM 378 C PRO A 27 28.452-106.108 1.277 1.00 34.14 C ATOM 379 O PRO A 27 27.243-106.132 1.024 1.00 11.14 O ATOM 380 CB PRO A 27 29.919-108.051 0.602 1.00 53.44 C ATOM 381 CG PRO A 27 28.902-108.960 -0.007 1.00 33.13 C ATOM 382 CD PRO A 27 28.010-109.414 1.127 1.00 61.22 C ATOM 0 HA PRO A 27 29.834-107.029 2.558 1.00 71.44 H new ATOM 0 HB2 PRO A 27 30.284-107.322 -0.121 1.00 53.44 H new ATOM 0 HB3 PRO A 27 30.786-108.607 0.959 1.00 53.44 H new ATOM 0 HG2 PRO A 27 28.325-108.441 -0.773 1.00 33.13 H new ATOM 0 HG3 PRO A 27 29.381-109.811 -0.491 1.00 33.13 H new ATOM 0 HD2 PRO A 27 26.964-109.445 0.824 1.00 61.22 H new ATOM 0 HD3 PRO A 27 28.274-110.416 1.466 1.00 61.22 H new ATOM 390 N SER A 28 29.197-105.014 1.150 1.00 3.22 N ATOM 391 CA SER A 28 28.635-103.730 0.741 1.00 34.34 C ATOM 392 C SER A 28 28.205-103.755 -0.732 1.00 61.20 C ATOM 393 O SER A 28 28.793-104.470 -1.552 1.00 25.04 O ATOM 394 CB SER A 28 29.665-102.620 0.985 1.00 12.32 C ATOM 395 OG SER A 28 30.947-102.999 0.508 1.00 70.24 O ATOM 0 H SER A 28 30.201-104.992 1.326 1.00 3.22 H new ATOM 0 HA SER A 28 27.745-103.533 1.338 1.00 34.34 H new ATOM 0 HB2 SER A 28 29.344-101.705 0.486 1.00 12.32 H new ATOM 0 HB3 SER A 28 29.721-102.399 2.051 1.00 12.32 H new ATOM 0 HG SER A 28 31.585-102.274 0.674 1.00 70.24 H new ATOM 401 N SER A 29 27.170-102.983 -1.058 1.00 60.23 N ATOM 402 CA SER A 29 26.656-102.908 -2.419 1.00 32.34 C ATOM 403 C SER A 29 27.399-101.833 -3.215 1.00 73.11 C ATOM 404 O SER A 29 27.511-100.686 -2.776 1.00 31.03 O ATOM 405 CB SER A 29 25.151-102.608 -2.389 1.00 33.44 C ATOM 406 OG SER A 29 24.457-103.572 -1.607 1.00 52.53 O ATOM 0 H SER A 29 26.669-102.397 -0.390 1.00 60.23 H new ATOM 0 HA SER A 29 26.817-103.867 -2.910 1.00 32.34 H new ATOM 0 HB2 SER A 29 24.983-101.612 -1.979 1.00 33.44 H new ATOM 0 HB3 SER A 29 24.756-102.606 -3.405 1.00 33.44 H new ATOM 0 HG SER A 29 23.500-103.360 -1.600 1.00 52.53 H new ATOM 412 N SER A 30 27.910-102.211 -4.381 1.00 64.34 N ATOM 413 CA SER A 30 28.658-101.292 -5.227 1.00 21.24 C ATOM 414 C SER A 30 27.712-100.463 -6.096 1.00 2.22 C ATOM 415 O SER A 30 27.327-100.881 -7.192 1.00 33.13 O ATOM 416 CB SER A 30 29.647-102.078 -6.094 1.00 51.34 C ATOM 417 OG SER A 30 30.447-102.937 -5.295 1.00 75.40 O ATOM 0 H SER A 30 27.819-103.153 -4.762 1.00 64.34 H new ATOM 0 HA SER A 30 29.216-100.603 -4.593 1.00 21.24 H new ATOM 0 HB2 SER A 30 29.102-102.665 -6.834 1.00 51.34 H new ATOM 0 HB3 SER A 30 30.285-101.386 -6.643 1.00 51.34 H new ATOM 0 HG SER A 30 31.070-103.431 -5.868 1.00 75.40 H new ATOM 423 N GLU A 31 27.294 -99.312 -5.573 1.00 40.24 N ATOM 424 CA GLU A 31 26.454 -98.376 -6.319 1.00 62.35 C ATOM 425 C GLU A 31 27.317 -97.237 -6.860 1.00 41.11 C ATOM 426 O GLU A 31 27.767 -96.371 -6.101 1.00 60.14 O ATOM 427 CB GLU A 31 25.340 -97.821 -5.418 1.00 12.31 C ATOM 428 CG GLU A 31 24.501 -98.902 -4.745 1.00 22.01 C ATOM 429 CD GLU A 31 23.393 -98.332 -3.874 1.00 14.11 C ATOM 430 OE1 GLU A 31 23.702 -97.549 -2.948 1.00 55.42 O ATOM 431 OE2 GLU A 31 22.210 -98.667 -4.104 1.00 62.50 O ATOM 0 H GLU A 31 27.525 -99.003 -4.629 1.00 40.24 H new ATOM 0 HA GLU A 31 25.988 -98.900 -7.154 1.00 62.35 H new ATOM 0 HB2 GLU A 31 25.787 -97.189 -4.650 1.00 12.31 H new ATOM 0 HB3 GLU A 31 24.686 -97.184 -6.014 1.00 12.31 H new ATOM 0 HG2 GLU A 31 24.062 -99.543 -5.509 1.00 22.01 H new ATOM 0 HG3 GLU A 31 25.149 -99.531 -4.135 1.00 22.01 H new ATOM 438 N ASP A 32 27.554 -97.249 -8.164 1.00 41.14 N ATOM 439 CA ASP A 32 28.476 -96.303 -8.795 1.00 53.41 C ATOM 440 C ASP A 32 27.776 -94.984 -9.108 1.00 74.21 C ATOM 441 O ASP A 32 28.389 -93.913 -9.071 1.00 0.32 O ATOM 442 CB ASP A 32 29.038 -96.899 -10.094 1.00 20.24 C ATOM 443 CG ASP A 32 29.537 -98.325 -9.925 1.00 71.33 C ATOM 444 OD1 ASP A 32 28.725 -99.267 -10.095 1.00 22.21 O ATOM 445 OD2 ASP A 32 30.736 -98.520 -9.630 1.00 71.55 O ATOM 0 H ASP A 32 27.120 -97.906 -8.813 1.00 41.14 H new ATOM 0 HA ASP A 32 29.290 -96.112 -8.096 1.00 53.41 H new ATOM 0 HB2 ASP A 32 28.264 -96.879 -10.861 1.00 20.24 H new ATOM 0 HB3 ASP A 32 29.856 -96.273 -10.450 1.00 20.24 H new ATOM 450 N VAL A 33 26.483 -95.065 -9.405 1.00 64.33 N ATOM 451 CA VAL A 33 25.699 -93.893 -9.790 1.00 3.41 C ATOM 452 C VAL A 33 24.503 -93.715 -8.860 1.00 52.31 C ATOM 453 O VAL A 33 23.813 -94.680 -8.538 1.00 55.05 O ATOM 454 CB VAL A 33 25.190 -94.009 -11.254 1.00 32.24 C ATOM 455 CG1 VAL A 33 24.379 -92.773 -11.656 1.00 21.34 C ATOM 456 CG2 VAL A 33 26.359 -94.228 -12.215 1.00 54.35 C ATOM 0 H VAL A 33 25.952 -95.935 -9.387 1.00 64.33 H new ATOM 0 HA VAL A 33 26.355 -93.026 -9.711 1.00 3.41 H new ATOM 0 HB VAL A 33 24.530 -94.875 -11.314 1.00 32.24 H new ATOM 0 HG11 VAL A 33 24.036 -92.882 -12.685 1.00 21.34 H new ATOM 0 HG12 VAL A 33 23.518 -92.672 -10.995 1.00 21.34 H new ATOM 0 HG13 VAL A 33 25.005 -91.885 -11.575 1.00 21.34 H new ATOM 0 HG21 VAL A 33 25.982 -94.307 -13.235 1.00 54.35 H new ATOM 0 HG22 VAL A 33 27.048 -93.387 -12.147 1.00 54.35 H new ATOM 0 HG23 VAL A 33 26.881 -95.147 -11.949 1.00 54.35 H new ATOM 466 N THR A 34 24.271 -92.483 -8.424 1.00 32.15 N ATOM 467 CA THR A 34 23.109 -92.160 -7.608 1.00 71.11 C ATOM 468 C THR A 34 21.983 -91.639 -8.504 1.00 2.24 C ATOM 469 O THR A 34 22.240 -90.940 -9.486 1.00 60.35 O ATOM 470 CB THR A 34 23.471 -91.109 -6.534 1.00 3.00 C ATOM 471 OG1 THR A 34 24.605 -91.569 -5.778 1.00 50.55 O ATOM 472 CG2 THR A 34 22.302 -90.843 -5.589 1.00 1.10 C ATOM 0 H THR A 34 24.877 -91.687 -8.624 1.00 32.15 H new ATOM 0 HA THR A 34 22.774 -93.063 -7.098 1.00 71.11 H new ATOM 0 HB THR A 34 23.710 -90.175 -7.043 1.00 3.00 H new ATOM 0 HG1 THR A 34 25.341 -90.929 -5.871 1.00 50.55 H new ATOM 0 HG21 THR A 34 22.595 -90.099 -4.848 1.00 1.10 H new ATOM 0 HG22 THR A 34 21.450 -90.472 -6.159 1.00 1.10 H new ATOM 0 HG23 THR A 34 22.025 -91.768 -5.084 1.00 1.10 H new ATOM 480 N THR A 35 20.744 -92.002 -8.186 1.00 71.32 N ATOM 481 CA THR A 35 19.595 -91.611 -8.997 1.00 44.34 C ATOM 482 C THR A 35 18.350 -91.451 -8.133 1.00 64.43 C ATOM 483 O THR A 35 18.052 -92.305 -7.296 1.00 74.11 O ATOM 484 CB THR A 35 19.318 -92.656 -10.106 1.00 51.43 C ATOM 485 OG1 THR A 35 20.431 -92.705 -11.014 1.00 13.30 O ATOM 486 CG2 THR A 35 18.036 -92.338 -10.876 1.00 62.32 C ATOM 0 H THR A 35 20.509 -92.568 -7.370 1.00 71.32 H new ATOM 0 HA THR A 35 19.833 -90.654 -9.461 1.00 44.34 H new ATOM 0 HB THR A 35 19.187 -93.626 -9.627 1.00 51.43 H new ATOM 0 HG1 THR A 35 20.908 -93.554 -10.901 1.00 13.30 H new ATOM 0 HG21 THR A 35 17.877 -93.094 -11.645 1.00 62.32 H new ATOM 0 HG22 THR A 35 17.190 -92.335 -10.189 1.00 62.32 H new ATOM 0 HG23 THR A 35 18.126 -91.358 -11.344 1.00 62.32 H new ATOM 494 N LEU A 36 17.645 -90.339 -8.325 1.00 13.40 N ATOM 495 CA LEU A 36 16.364 -90.104 -7.664 1.00 32.23 C ATOM 496 C LEU A 36 15.455 -89.307 -8.595 1.00 30.20 C ATOM 497 O LEU A 36 15.920 -88.430 -9.327 1.00 35.32 O ATOM 498 CB LEU A 36 16.524 -89.353 -6.323 1.00 70.33 C ATOM 499 CG LEU A 36 17.301 -90.096 -5.213 1.00 3.23 C ATOM 500 CD1 LEU A 36 18.786 -89.737 -5.242 1.00 10.31 C ATOM 501 CD2 LEU A 36 16.693 -89.814 -3.838 1.00 4.14 C ATOM 0 H LEU A 36 17.943 -89.580 -8.938 1.00 13.40 H new ATOM 0 HA LEU A 36 15.923 -91.075 -7.441 1.00 32.23 H new ATOM 0 HB2 LEU A 36 17.028 -88.406 -6.519 1.00 70.33 H new ATOM 0 HB3 LEU A 36 15.531 -89.113 -5.944 1.00 70.33 H new ATOM 0 HG LEU A 36 17.216 -91.166 -5.405 1.00 3.23 H new ATOM 0 HD11 LEU A 36 19.306 -90.275 -4.450 1.00 10.31 H new ATOM 0 HD12 LEU A 36 19.209 -90.015 -6.207 1.00 10.31 H new ATOM 0 HD13 LEU A 36 18.904 -88.664 -5.090 1.00 10.31 H new ATOM 0 HD21 LEU A 36 17.258 -90.348 -3.074 1.00 4.14 H new ATOM 0 HD22 LEU A 36 16.732 -88.744 -3.636 1.00 4.14 H new ATOM 0 HD23 LEU A 36 15.656 -90.149 -3.823 1.00 4.14 H new ATOM 513 N CYS A 37 14.166 -89.625 -8.578 1.00 71.23 N ATOM 514 CA CYS A 37 13.187 -88.927 -9.408 1.00 40.31 C ATOM 515 C CYS A 37 12.699 -87.666 -8.699 1.00 32.44 C ATOM 516 O CYS A 37 12.448 -87.682 -7.494 1.00 34.41 O ATOM 517 CB CYS A 37 12.005 -89.850 -9.726 1.00 1.21 C ATOM 518 SG CYS A 37 12.495 -91.457 -10.390 1.00 21.43 S ATOM 0 H CYS A 37 13.772 -90.365 -7.997 1.00 71.23 H new ATOM 0 HA CYS A 37 13.664 -88.639 -10.345 1.00 40.31 H new ATOM 0 HB2 CYS A 37 11.422 -90.005 -8.818 1.00 1.21 H new ATOM 0 HB3 CYS A 37 11.352 -89.354 -10.444 1.00 1.21 H new ATOM 0 HG CYS A 37 11.434 -92.170 -10.627 1.00 21.43 H new ATOM 524 N TYR A 38 12.576 -86.582 -9.449 1.00 44.52 N ATOM 525 CA TYR A 38 12.158 -85.295 -8.905 1.00 13.14 C ATOM 526 C TYR A 38 10.777 -84.925 -9.434 1.00 33.50 C ATOM 527 O TYR A 38 10.479 -85.152 -10.603 1.00 34.40 O ATOM 528 CB TYR A 38 13.174 -84.204 -9.290 1.00 2.52 C ATOM 529 CG TYR A 38 14.495 -84.274 -8.534 1.00 51.01 C ATOM 530 CD1 TYR A 38 15.188 -85.472 -8.386 1.00 5.21 C ATOM 531 CD2 TYR A 38 15.043 -83.132 -7.963 1.00 74.21 C ATOM 532 CE1 TYR A 38 16.385 -85.524 -7.694 1.00 42.41 C ATOM 533 CE2 TYR A 38 16.236 -83.178 -7.271 1.00 41.03 C ATOM 534 CZ TYR A 38 16.902 -84.374 -7.138 1.00 0.42 C ATOM 535 OH TYR A 38 18.091 -84.416 -6.449 1.00 72.24 O ATOM 0 H TYR A 38 12.763 -86.567 -10.452 1.00 44.52 H new ATOM 0 HA TYR A 38 12.113 -85.372 -7.819 1.00 13.14 H new ATOM 0 HB2 TYR A 38 13.377 -84.276 -10.358 1.00 2.52 H new ATOM 0 HB3 TYR A 38 12.722 -83.227 -9.116 1.00 2.52 H new ATOM 0 HD1 TYR A 38 14.785 -86.376 -8.818 1.00 5.21 H new ATOM 0 HD2 TYR A 38 14.525 -82.190 -8.063 1.00 74.21 H new ATOM 0 HE1 TYR A 38 16.912 -86.461 -7.590 1.00 42.41 H new ATOM 0 HE2 TYR A 38 16.645 -82.278 -6.836 1.00 41.03 H new ATOM 0 HH TYR A 38 18.712 -83.760 -6.829 1.00 72.24 H new ATOM 545 N ARG A 39 9.937 -84.369 -8.569 1.00 41.31 N ATOM 546 CA ARG A 39 8.618 -83.879 -8.969 1.00 13.40 C ATOM 547 C ARG A 39 8.239 -82.665 -8.125 1.00 14.02 C ATOM 548 O ARG A 39 8.208 -82.744 -6.899 1.00 25.40 O ATOM 549 CB ARG A 39 7.560 -84.988 -8.834 1.00 74.33 C ATOM 550 CG ARG A 39 6.165 -84.545 -9.268 1.00 12.21 C ATOM 551 CD ARG A 39 5.206 -85.719 -9.446 1.00 54.31 C ATOM 552 NE ARG A 39 4.960 -86.445 -8.196 1.00 25.32 N ATOM 553 CZ ARG A 39 3.759 -86.879 -7.809 1.00 14.22 C ATOM 554 NH1 ARG A 39 2.692 -86.675 -8.572 1.00 32.13 N ATOM 555 NH2 ARG A 39 3.634 -87.538 -6.665 1.00 64.21 N ATOM 0 H ARG A 39 10.146 -84.244 -7.578 1.00 41.31 H new ATOM 0 HA ARG A 39 8.657 -83.581 -10.017 1.00 13.40 H new ATOM 0 HB2 ARG A 39 7.864 -85.846 -9.433 1.00 74.33 H new ATOM 0 HB3 ARG A 39 7.522 -85.321 -7.797 1.00 74.33 H new ATOM 0 HG2 ARG A 39 5.759 -83.858 -8.526 1.00 12.21 H new ATOM 0 HG3 ARG A 39 6.238 -83.995 -10.206 1.00 12.21 H new ATOM 0 HD2 ARG A 39 4.258 -85.352 -9.840 1.00 54.31 H new ATOM 0 HD3 ARG A 39 5.614 -86.407 -10.186 1.00 54.31 H new ATOM 0 HE ARG A 39 5.756 -86.630 -7.585 1.00 25.32 H new ATOM 0 HH11 ARG A 39 2.787 -86.184 -9.461 1.00 32.13 H new ATOM 0 HH12 ARG A 39 1.777 -87.010 -8.270 1.00 32.13 H new ATOM 0 HH21 ARG A 39 4.454 -87.712 -6.084 1.00 64.21 H new ATOM 0 HH22 ARG A 39 2.718 -87.871 -6.366 1.00 64.21 H new ATOM 569 N VAL A 40 7.950 -81.550 -8.785 1.00 72.34 N ATOM 570 CA VAL A 40 7.694 -80.284 -8.093 1.00 72.44 C ATOM 571 C VAL A 40 6.490 -79.567 -8.698 1.00 70.43 C ATOM 572 O VAL A 40 6.204 -79.722 -9.878 1.00 61.43 O ATOM 573 CB VAL A 40 8.939 -79.358 -8.162 1.00 33.24 C ATOM 574 CG1 VAL A 40 9.238 -78.933 -9.600 1.00 32.30 C ATOM 575 CG2 VAL A 40 8.769 -78.142 -7.253 1.00 22.25 C ATOM 0 H VAL A 40 7.886 -81.493 -9.801 1.00 72.34 H new ATOM 0 HA VAL A 40 7.480 -80.515 -7.049 1.00 72.44 H new ATOM 0 HB VAL A 40 9.795 -79.928 -7.803 1.00 33.24 H new ATOM 0 HG11 VAL A 40 10.115 -78.286 -9.613 1.00 32.30 H new ATOM 0 HG12 VAL A 40 9.430 -79.817 -10.208 1.00 32.30 H new ATOM 0 HG13 VAL A 40 8.382 -78.393 -10.005 1.00 32.30 H new ATOM 0 HG21 VAL A 40 9.655 -77.511 -7.320 1.00 22.25 H new ATOM 0 HG22 VAL A 40 7.893 -77.573 -7.566 1.00 22.25 H new ATOM 0 HG23 VAL A 40 8.637 -78.473 -6.223 1.00 22.25 H new ATOM 585 N THR A 41 5.782 -78.790 -7.889 1.00 2.24 N ATOM 586 CA THR A 41 4.620 -78.049 -8.360 1.00 62.42 C ATOM 587 C THR A 41 4.979 -76.589 -8.664 1.00 74.20 C ATOM 588 O THR A 41 5.397 -75.845 -7.771 1.00 2.33 O ATOM 589 CB THR A 41 3.482 -78.096 -7.313 1.00 55.34 C ATOM 590 OG1 THR A 41 3.996 -77.772 -6.012 1.00 61.12 O ATOM 591 CG2 THR A 41 2.828 -79.473 -7.273 1.00 64.10 C ATOM 0 H THR A 41 5.993 -78.656 -6.900 1.00 2.24 H new ATOM 0 HA THR A 41 4.280 -78.523 -9.281 1.00 62.42 H new ATOM 0 HB THR A 41 2.729 -77.363 -7.603 1.00 55.34 H new ATOM 0 HG1 THR A 41 3.312 -77.956 -5.335 1.00 61.12 H new ATOM 0 HG21 THR A 41 2.032 -79.476 -6.528 1.00 64.10 H new ATOM 0 HG22 THR A 41 2.410 -79.706 -8.252 1.00 64.10 H new ATOM 0 HG23 THR A 41 3.574 -80.223 -7.010 1.00 64.10 H new ATOM 599 N GLY A 42 4.833 -76.195 -9.930 1.00 41.40 N ATOM 600 CA GLY A 42 5.042 -74.808 -10.320 1.00 24.42 C ATOM 601 C GLY A 42 3.763 -74.006 -10.183 1.00 40.24 C ATOM 602 O GLY A 42 2.680 -74.589 -10.100 1.00 32.35 O ATOM 0 H GLY A 42 4.572 -76.816 -10.696 1.00 41.40 H new ATOM 0 HA2 GLY A 42 5.821 -74.366 -9.699 1.00 24.42 H new ATOM 0 HA3 GLY A 42 5.393 -74.765 -11.351 1.00 24.42 H new ATOM 606 N LYS A 43 3.863 -72.680 -10.159 1.00 4.30 N ATOM 607 CA LYS A 43 2.682 -71.847 -9.954 1.00 54.14 C ATOM 608 C LYS A 43 2.737 -70.564 -10.783 1.00 34.03 C ATOM 609 O LYS A 43 2.095 -70.454 -11.829 1.00 15.12 O ATOM 610 CB LYS A 43 2.537 -71.496 -8.465 1.00 24.05 C ATOM 611 CG LYS A 43 1.149 -70.981 -8.091 1.00 42.10 C ATOM 612 CD LYS A 43 0.071 -72.036 -8.332 1.00 4.43 C ATOM 613 CE LYS A 43 -1.330 -71.498 -8.060 1.00 3.20 C ATOM 614 NZ LYS A 43 -1.478 -70.999 -6.667 1.00 10.25 N ATOM 0 H LYS A 43 4.736 -72.165 -10.277 1.00 4.30 H new ATOM 0 HA LYS A 43 1.816 -72.421 -10.284 1.00 54.14 H new ATOM 0 HB2 LYS A 43 2.760 -72.380 -7.868 1.00 24.05 H new ATOM 0 HB3 LYS A 43 3.278 -70.740 -8.204 1.00 24.05 H new ATOM 0 HG2 LYS A 43 1.141 -70.686 -7.042 1.00 42.10 H new ATOM 0 HG3 LYS A 43 0.922 -70.089 -8.675 1.00 42.10 H new ATOM 0 HD2 LYS A 43 0.131 -72.386 -9.363 1.00 4.43 H new ATOM 0 HD3 LYS A 43 0.258 -72.898 -7.692 1.00 4.43 H new ATOM 0 HE2 LYS A 43 -1.550 -70.691 -8.759 1.00 3.20 H new ATOM 0 HE3 LYS A 43 -2.062 -72.285 -8.242 1.00 3.20 H new ATOM 0 HZ1 LYS A 43 -2.478 -70.786 -6.479 1.00 10.25 H new ATOM 0 HZ2 LYS A 43 -1.148 -71.726 -6.001 1.00 10.25 H new ATOM 0 HZ3 LYS A 43 -0.911 -70.136 -6.545 1.00 10.25 H new ATOM 628 N VAL A 44 3.503 -69.593 -10.297 1.00 15.21 N ATOM 629 CA VAL A 44 3.597 -68.282 -10.933 1.00 11.51 C ATOM 630 C VAL A 44 4.873 -68.195 -11.757 1.00 43.13 C ATOM 631 O VAL A 44 5.872 -68.830 -11.411 1.00 73.31 O ATOM 632 CB VAL A 44 3.584 -67.148 -9.875 1.00 65.30 C ATOM 633 CG1 VAL A 44 3.675 -65.771 -10.535 1.00 4.45 C ATOM 634 CG2 VAL A 44 2.338 -67.249 -8.995 1.00 65.34 C ATOM 0 H VAL A 44 4.073 -69.690 -9.457 1.00 15.21 H new ATOM 0 HA VAL A 44 2.732 -68.158 -11.584 1.00 11.51 H new ATOM 0 HB VAL A 44 4.463 -67.269 -9.242 1.00 65.30 H new ATOM 0 HG11 VAL A 44 3.664 -64.998 -9.767 1.00 4.45 H new ATOM 0 HG12 VAL A 44 4.601 -65.702 -11.106 1.00 4.45 H new ATOM 0 HG13 VAL A 44 2.825 -65.631 -11.203 1.00 4.45 H new ATOM 0 HG21 VAL A 44 2.346 -66.445 -8.259 1.00 65.34 H new ATOM 0 HG22 VAL A 44 1.446 -67.163 -9.616 1.00 65.34 H new ATOM 0 HG23 VAL A 44 2.332 -68.211 -8.482 1.00 65.34 H new ATOM 644 N GLN A 45 4.825 -67.417 -12.839 1.00 50.12 N ATOM 645 CA GLN A 45 5.972 -67.237 -13.725 1.00 32.13 C ATOM 646 C GLN A 45 6.320 -68.568 -14.394 1.00 53.04 C ATOM 647 O GLN A 45 7.299 -69.230 -14.034 1.00 31.24 O ATOM 648 CB GLN A 45 7.176 -66.679 -12.945 1.00 23.21 C ATOM 649 CG GLN A 45 8.371 -66.303 -13.815 1.00 74.44 C ATOM 650 CD GLN A 45 8.150 -65.047 -14.642 1.00 75.11 C ATOM 651 OE1 GLN A 45 8.690 -64.914 -15.739 1.00 53.52 O ATOM 652 NE2 GLN A 45 7.380 -64.107 -14.113 1.00 75.34 N ATOM 0 H GLN A 45 3.995 -66.897 -13.123 1.00 50.12 H new ATOM 0 HA GLN A 45 5.715 -66.514 -14.499 1.00 32.13 H new ATOM 0 HB2 GLN A 45 6.856 -65.798 -12.388 1.00 23.21 H new ATOM 0 HB3 GLN A 45 7.494 -67.421 -12.213 1.00 23.21 H new ATOM 0 HG2 GLN A 45 9.243 -66.159 -13.177 1.00 74.44 H new ATOM 0 HG3 GLN A 45 8.598 -67.133 -14.484 1.00 74.44 H new ATOM 0 HE21 GLN A 45 6.949 -64.254 -13.200 1.00 75.34 H new ATOM 0 HE22 GLN A 45 7.218 -63.236 -14.619 1.00 75.34 H new ATOM 661 N GLY A 46 5.477 -68.971 -15.343 1.00 33.40 N ATOM 662 CA GLY A 46 5.657 -70.244 -16.017 1.00 5.31 C ATOM 663 C GLY A 46 5.492 -71.413 -15.062 1.00 42.35 C ATOM 664 O GLY A 46 4.564 -71.428 -14.251 1.00 52.52 O ATOM 0 H GLY A 46 4.669 -68.434 -15.657 1.00 33.40 H new ATOM 0 HA2 GLY A 46 4.934 -70.332 -16.828 1.00 5.31 H new ATOM 0 HA3 GLY A 46 6.648 -70.280 -16.468 1.00 5.31 H new ATOM 668 N VAL A 47 6.392 -72.384 -15.157 1.00 50.43 N ATOM 669 CA VAL A 47 6.397 -73.539 -14.256 1.00 62.01 C ATOM 670 C VAL A 47 7.830 -73.907 -13.882 1.00 63.33 C ATOM 671 O VAL A 47 8.101 -74.329 -12.758 1.00 24.14 O ATOM 672 CB VAL A 47 5.691 -74.779 -14.878 1.00 61.21 C ATOM 673 CG1 VAL A 47 4.187 -74.542 -15.023 1.00 73.20 C ATOM 674 CG2 VAL A 47 6.315 -75.149 -16.226 1.00 13.12 C ATOM 0 H VAL A 47 7.136 -72.397 -15.855 1.00 50.43 H new ATOM 0 HA VAL A 47 5.839 -73.250 -13.365 1.00 62.01 H new ATOM 0 HB VAL A 47 5.835 -75.618 -14.197 1.00 61.21 H new ATOM 0 HG11 VAL A 47 3.720 -75.425 -15.460 1.00 73.20 H new ATOM 0 HG12 VAL A 47 3.753 -74.350 -14.042 1.00 73.20 H new ATOM 0 HG13 VAL A 47 4.015 -73.682 -15.671 1.00 73.20 H new ATOM 0 HG21 VAL A 47 5.803 -76.018 -16.638 1.00 13.12 H new ATOM 0 HG22 VAL A 47 6.217 -74.310 -16.915 1.00 13.12 H new ATOM 0 HG23 VAL A 47 7.371 -75.382 -16.087 1.00 13.12 H new ATOM 684 N PHE A 48 8.742 -73.744 -14.842 1.00 44.21 N ATOM 685 CA PHE A 48 10.151 -74.067 -14.641 1.00 43.23 C ATOM 686 C PHE A 48 10.972 -73.521 -15.813 1.00 63.04 C ATOM 687 O PHE A 48 10.676 -73.811 -16.975 1.00 45.54 O ATOM 688 CB PHE A 48 10.329 -75.594 -14.520 1.00 61.12 C ATOM 689 CG PHE A 48 11.303 -76.026 -13.453 1.00 53.24 C ATOM 690 CD1 PHE A 48 11.093 -75.677 -12.126 1.00 42.11 C ATOM 691 CD2 PHE A 48 12.421 -76.788 -13.772 1.00 54.45 C ATOM 692 CE1 PHE A 48 11.974 -76.074 -11.141 1.00 23.41 C ATOM 693 CE2 PHE A 48 13.304 -77.188 -12.788 1.00 23.53 C ATOM 694 CZ PHE A 48 13.080 -76.830 -11.472 1.00 52.33 C ATOM 0 H PHE A 48 8.525 -73.387 -15.773 1.00 44.21 H new ATOM 0 HA PHE A 48 10.502 -73.605 -13.718 1.00 43.23 H new ATOM 0 HB2 PHE A 48 9.359 -76.045 -14.313 1.00 61.12 H new ATOM 0 HB3 PHE A 48 10.664 -75.986 -15.480 1.00 61.12 H new ATOM 0 HD1 PHE A 48 10.228 -75.087 -11.861 1.00 42.11 H new ATOM 0 HD2 PHE A 48 12.601 -77.070 -14.799 1.00 54.45 H new ATOM 0 HE1 PHE A 48 11.798 -75.794 -10.113 1.00 23.41 H new ATOM 0 HE2 PHE A 48 14.169 -77.780 -13.047 1.00 23.53 H new ATOM 0 HZ PHE A 48 13.771 -77.142 -10.703 1.00 52.33 H new ATOM 704 N PHE A 49 11.984 -72.717 -15.508 1.00 15.34 N ATOM 705 CA PHE A 49 12.809 -72.095 -16.540 1.00 4.40 C ATOM 706 C PHE A 49 13.914 -73.031 -17.016 1.00 62.32 C ATOM 707 O PHE A 49 14.888 -73.292 -16.296 1.00 1.00 O ATOM 708 CB PHE A 49 13.417 -70.785 -16.036 1.00 33.40 C ATOM 709 CG PHE A 49 12.483 -69.603 -16.105 1.00 61.25 C ATOM 710 CD1 PHE A 49 12.113 -69.074 -17.333 1.00 2.54 C ATOM 711 CD2 PHE A 49 11.992 -69.013 -14.950 1.00 61.52 C ATOM 712 CE1 PHE A 49 11.274 -67.981 -17.409 1.00 70.11 C ATOM 713 CE2 PHE A 49 11.150 -67.920 -15.023 1.00 52.45 C ATOM 714 CZ PHE A 49 10.792 -67.403 -16.254 1.00 63.23 C ATOM 0 H PHE A 49 12.254 -72.480 -14.554 1.00 15.34 H new ATOM 0 HA PHE A 49 12.157 -71.880 -17.387 1.00 4.40 H new ATOM 0 HB2 PHE A 49 13.738 -70.920 -15.003 1.00 33.40 H new ATOM 0 HB3 PHE A 49 14.310 -70.563 -16.621 1.00 33.40 H new ATOM 0 HD1 PHE A 49 12.486 -69.523 -18.241 1.00 2.54 H new ATOM 0 HD2 PHE A 49 12.270 -69.411 -13.985 1.00 61.52 H new ATOM 0 HE1 PHE A 49 10.995 -67.579 -18.372 1.00 70.11 H new ATOM 0 HE2 PHE A 49 10.771 -67.469 -14.118 1.00 52.45 H new ATOM 0 HZ PHE A 49 10.136 -66.547 -16.311 1.00 63.23 H new ATOM 724 N ARG A 50 13.757 -73.507 -18.250 1.00 20.24 N ATOM 725 CA ARG A 50 14.748 -74.358 -18.903 1.00 11.11 C ATOM 726 C ARG A 50 16.132 -73.708 -18.867 1.00 62.02 C ATOM 727 O ARG A 50 17.144 -74.399 -18.884 1.00 13.04 O ATOM 728 CB ARG A 50 14.331 -74.634 -20.358 1.00 4.24 C ATOM 729 CG ARG A 50 12.988 -75.353 -20.489 1.00 63.42 C ATOM 730 CD ARG A 50 12.554 -75.518 -21.944 1.00 31.41 C ATOM 731 NE ARG A 50 13.488 -76.340 -22.719 1.00 52.04 N ATOM 732 CZ ARG A 50 13.154 -77.036 -23.807 1.00 22.45 C ATOM 733 NH1 ARG A 50 11.900 -77.044 -24.246 1.00 12.14 N ATOM 734 NH2 ARG A 50 14.084 -77.724 -24.454 1.00 70.43 N ATOM 0 H ARG A 50 12.938 -73.313 -18.825 1.00 20.24 H new ATOM 0 HA ARG A 50 14.799 -75.303 -18.361 1.00 11.11 H new ATOM 0 HB2 ARG A 50 14.280 -73.688 -20.897 1.00 4.24 H new ATOM 0 HB3 ARG A 50 15.103 -75.235 -20.840 1.00 4.24 H new ATOM 0 HG2 ARG A 50 13.057 -76.335 -20.020 1.00 63.42 H new ATOM 0 HG3 ARG A 50 12.225 -74.794 -19.947 1.00 63.42 H new ATOM 0 HD2 ARG A 50 11.564 -75.972 -21.975 1.00 31.41 H new ATOM 0 HD3 ARG A 50 12.469 -74.535 -22.408 1.00 31.41 H new ATOM 0 HE ARG A 50 14.458 -76.383 -22.406 1.00 52.04 H new ATOM 0 HH11 ARG A 50 11.183 -76.515 -23.750 1.00 12.14 H new ATOM 0 HH12 ARG A 50 11.655 -77.579 -25.079 1.00 12.14 H new ATOM 0 HH21 ARG A 50 15.047 -77.719 -24.119 1.00 70.43 H new ATOM 0 HH22 ARG A 50 13.836 -78.259 -25.287 1.00 70.43 H new ATOM 748 N LYS A 51 16.161 -72.374 -18.808 1.00 31.42 N ATOM 749 CA LYS A 51 17.416 -71.623 -18.744 1.00 51.24 C ATOM 750 C LYS A 51 18.206 -71.983 -17.483 1.00 43.40 C ATOM 751 O LYS A 51 19.314 -72.527 -17.563 1.00 4.25 O ATOM 752 CB LYS A 51 17.140 -70.109 -18.779 1.00 42.54 C ATOM 753 CG LYS A 51 16.490 -69.629 -20.075 1.00 63.21 C ATOM 754 CD LYS A 51 16.257 -68.118 -20.064 1.00 2.41 C ATOM 755 CE LYS A 51 15.691 -67.616 -21.391 1.00 61.10 C ATOM 756 NZ LYS A 51 15.485 -66.141 -21.384 1.00 63.52 N ATOM 0 H LYS A 51 15.325 -71.790 -18.803 1.00 31.42 H new ATOM 0 HA LYS A 51 18.014 -71.893 -19.614 1.00 51.24 H new ATOM 0 HB2 LYS A 51 16.493 -69.848 -17.941 1.00 42.54 H new ATOM 0 HB3 LYS A 51 18.079 -69.575 -18.635 1.00 42.54 H new ATOM 0 HG2 LYS A 51 17.125 -69.893 -20.920 1.00 63.21 H new ATOM 0 HG3 LYS A 51 15.539 -70.143 -20.218 1.00 63.21 H new ATOM 0 HD2 LYS A 51 15.570 -67.863 -19.257 1.00 2.41 H new ATOM 0 HD3 LYS A 51 17.197 -67.608 -19.855 1.00 2.41 H new ATOM 0 HE2 LYS A 51 16.370 -67.884 -22.200 1.00 61.10 H new ATOM 0 HE3 LYS A 51 14.743 -68.114 -21.593 1.00 61.10 H new ATOM 0 HZ1 LYS A 51 15.100 -65.840 -22.302 1.00 63.52 H new ATOM 0 HZ2 LYS A 51 14.817 -65.887 -20.628 1.00 63.52 H new ATOM 0 HZ3 LYS A 51 16.394 -65.664 -21.217 1.00 63.52 H new ATOM 770 N TYR A 52 17.626 -71.689 -16.318 1.00 33.33 N ATOM 771 CA TYR A 52 18.294 -71.947 -15.045 1.00 52.21 C ATOM 772 C TYR A 52 18.515 -73.446 -14.863 1.00 31.13 C ATOM 773 O TYR A 52 19.547 -73.872 -14.340 1.00 33.12 O ATOM 774 CB TYR A 52 17.484 -71.384 -13.868 1.00 51.11 C ATOM 775 CG TYR A 52 17.241 -69.883 -13.935 1.00 65.03 C ATOM 776 CD1 TYR A 52 18.267 -68.974 -13.690 1.00 73.20 C ATOM 777 CD2 TYR A 52 15.984 -69.378 -14.239 1.00 31.11 C ATOM 778 CE1 TYR A 52 18.041 -67.609 -13.752 1.00 34.30 C ATOM 779 CE2 TYR A 52 15.752 -68.020 -14.305 1.00 52.05 C ATOM 780 CZ TYR A 52 16.780 -67.139 -14.059 1.00 23.30 C ATOM 781 OH TYR A 52 16.543 -65.784 -14.124 1.00 53.21 O ATOM 0 H TYR A 52 16.698 -71.274 -16.232 1.00 33.33 H new ATOM 0 HA TYR A 52 19.260 -71.442 -15.061 1.00 52.21 H new ATOM 0 HB2 TYR A 52 16.522 -71.894 -13.827 1.00 51.11 H new ATOM 0 HB3 TYR A 52 18.006 -71.614 -12.940 1.00 51.11 H new ATOM 0 HD1 TYR A 52 19.254 -69.339 -13.448 1.00 73.20 H new ATOM 0 HD2 TYR A 52 15.171 -70.063 -14.428 1.00 31.11 H new ATOM 0 HE1 TYR A 52 18.847 -66.916 -13.561 1.00 34.30 H new ATOM 0 HE2 TYR A 52 14.767 -67.650 -14.549 1.00 52.05 H new ATOM 0 HH TYR A 52 15.603 -65.627 -14.353 1.00 53.21 H new ATOM 791 N THR A 53 17.544 -74.242 -15.315 1.00 44.10 N ATOM 792 CA THR A 53 17.659 -75.695 -15.257 1.00 3.41 C ATOM 793 C THR A 53 18.860 -76.165 -16.086 1.00 73.23 C ATOM 794 O THR A 53 19.625 -77.034 -15.659 1.00 72.33 O ATOM 795 CB THR A 53 16.366 -76.371 -15.770 1.00 45.12 C ATOM 796 OG1 THR A 53 15.236 -75.812 -15.087 1.00 53.20 O ATOM 797 CG2 THR A 53 16.399 -77.882 -15.549 1.00 71.23 C ATOM 0 H THR A 53 16.673 -73.903 -15.724 1.00 44.10 H new ATOM 0 HA THR A 53 17.809 -75.983 -14.216 1.00 3.41 H new ATOM 0 HB THR A 53 16.288 -76.188 -16.842 1.00 45.12 H new ATOM 0 HG1 THR A 53 15.003 -74.950 -15.491 1.00 53.20 H new ATOM 0 HG21 THR A 53 15.475 -78.324 -15.921 1.00 71.23 H new ATOM 0 HG22 THR A 53 17.247 -78.310 -16.084 1.00 71.23 H new ATOM 0 HG23 THR A 53 16.499 -78.092 -14.484 1.00 71.23 H new ATOM 805 N LYS A 54 19.029 -75.558 -17.259 1.00 52.34 N ATOM 806 CA LYS A 54 20.140 -75.878 -18.147 1.00 30.44 C ATOM 807 C LYS A 54 21.467 -75.526 -17.486 1.00 3.54 C ATOM 808 O LYS A 54 22.403 -76.319 -17.504 1.00 44.10 O ATOM 809 CB LYS A 54 20.004 -75.116 -19.475 1.00 40.44 C ATOM 810 CG LYS A 54 21.108 -75.409 -20.494 1.00 35.45 C ATOM 811 CD LYS A 54 21.067 -76.856 -20.990 1.00 30.33 C ATOM 812 CE LYS A 54 22.079 -77.108 -22.108 1.00 3.15 C ATOM 813 NZ LYS A 54 23.487 -77.000 -21.639 1.00 23.31 N ATOM 0 H LYS A 54 18.404 -74.836 -17.617 1.00 52.34 H new ATOM 0 HA LYS A 54 20.117 -76.949 -18.350 1.00 30.44 H new ATOM 0 HB2 LYS A 54 19.041 -75.361 -19.922 1.00 40.44 H new ATOM 0 HB3 LYS A 54 19.995 -74.046 -19.266 1.00 40.44 H new ATOM 0 HG2 LYS A 54 21.006 -74.733 -21.343 1.00 35.45 H new ATOM 0 HG3 LYS A 54 22.080 -75.209 -20.042 1.00 35.45 H new ATOM 0 HD2 LYS A 54 21.271 -77.530 -20.158 1.00 30.33 H new ATOM 0 HD3 LYS A 54 20.064 -77.088 -21.350 1.00 30.33 H new ATOM 0 HE2 LYS A 54 21.914 -78.101 -22.526 1.00 3.15 H new ATOM 0 HE3 LYS A 54 21.912 -76.392 -22.913 1.00 3.15 H new ATOM 0 HZ1 LYS A 54 24.127 -76.993 -22.459 1.00 23.31 H new ATOM 0 HZ2 LYS A 54 23.607 -76.119 -21.099 1.00 23.31 H new ATOM 0 HZ3 LYS A 54 23.713 -77.812 -21.030 1.00 23.31 H new ATOM 827 N LYS A 55 21.533 -74.334 -16.893 1.00 61.15 N ATOM 828 CA LYS A 55 22.768 -73.851 -16.280 1.00 23.30 C ATOM 829 C LYS A 55 23.210 -74.767 -15.135 1.00 15.04 C ATOM 830 O LYS A 55 24.359 -75.213 -15.099 1.00 2.24 O ATOM 831 CB LYS A 55 22.601 -72.406 -15.781 1.00 11.43 C ATOM 832 CG LYS A 55 23.885 -71.804 -15.214 1.00 64.44 C ATOM 833 CD LYS A 55 23.731 -70.320 -14.900 1.00 65.33 C ATOM 834 CE LYS A 55 25.044 -69.713 -14.415 1.00 14.41 C ATOM 835 NZ LYS A 55 24.946 -68.243 -14.222 1.00 63.50 N ATOM 0 H LYS A 55 20.747 -73.687 -16.825 1.00 61.15 H new ATOM 0 HA LYS A 55 23.546 -73.864 -17.043 1.00 23.30 H new ATOM 0 HB2 LYS A 55 22.251 -71.784 -16.605 1.00 11.43 H new ATOM 0 HB3 LYS A 55 21.828 -72.383 -15.013 1.00 11.43 H new ATOM 0 HG2 LYS A 55 24.166 -72.339 -14.307 1.00 64.44 H new ATOM 0 HG3 LYS A 55 24.696 -71.941 -15.929 1.00 64.44 H new ATOM 0 HD2 LYS A 55 23.392 -69.792 -15.791 1.00 65.33 H new ATOM 0 HD3 LYS A 55 22.963 -70.186 -14.138 1.00 65.33 H new ATOM 0 HE2 LYS A 55 25.334 -70.182 -13.475 1.00 14.41 H new ATOM 0 HE3 LYS A 55 25.831 -69.931 -15.136 1.00 14.41 H new ATOM 0 HZ1 LYS A 55 25.861 -67.874 -13.892 1.00 63.50 H new ATOM 0 HZ2 LYS A 55 24.695 -67.790 -15.124 1.00 63.50 H new ATOM 0 HZ3 LYS A 55 24.213 -68.034 -13.514 1.00 63.50 H new ATOM 849 N GLU A 56 22.288 -75.049 -14.215 1.00 61.35 N ATOM 850 CA GLU A 56 22.567 -75.922 -13.072 1.00 4.44 C ATOM 851 C GLU A 56 22.983 -77.316 -13.558 1.00 34.44 C ATOM 852 O GLU A 56 24.061 -77.818 -13.221 1.00 61.15 O ATOM 853 CB GLU A 56 21.318 -76.028 -12.179 1.00 12.34 C ATOM 854 CG GLU A 56 21.507 -76.859 -10.907 1.00 53.51 C ATOM 855 CD GLU A 56 22.295 -76.142 -9.816 1.00 25.14 C ATOM 856 OE1 GLU A 56 21.906 -75.018 -9.428 1.00 63.10 O ATOM 857 OE2 GLU A 56 23.290 -76.708 -9.315 1.00 24.04 O ATOM 0 H GLU A 56 21.336 -74.684 -14.238 1.00 61.35 H new ATOM 0 HA GLU A 56 23.386 -75.494 -12.493 1.00 4.44 H new ATOM 0 HB2 GLU A 56 21.004 -75.023 -11.896 1.00 12.34 H new ATOM 0 HB3 GLU A 56 20.507 -76.463 -12.763 1.00 12.34 H new ATOM 0 HG2 GLU A 56 20.528 -77.133 -10.514 1.00 53.51 H new ATOM 0 HG3 GLU A 56 22.019 -77.786 -11.163 1.00 53.51 H new ATOM 864 N ALA A 57 22.128 -77.917 -14.387 1.00 2.01 N ATOM 865 CA ALA A 57 22.337 -79.281 -14.864 1.00 74.43 C ATOM 866 C ALA A 57 23.632 -79.408 -15.666 1.00 71.13 C ATOM 867 O ALA A 57 24.352 -80.394 -15.535 1.00 12.10 O ATOM 868 CB ALA A 57 21.146 -79.738 -15.701 1.00 4.12 C ATOM 0 H ALA A 57 21.280 -77.476 -14.743 1.00 2.01 H new ATOM 0 HA ALA A 57 22.427 -79.927 -13.990 1.00 74.43 H new ATOM 0 HB1 ALA A 57 21.316 -80.757 -16.050 1.00 4.12 H new ATOM 0 HB2 ALA A 57 20.242 -79.709 -15.093 1.00 4.12 H new ATOM 0 HB3 ALA A 57 21.028 -79.076 -16.559 1.00 4.12 H new ATOM 874 N ASP A 58 23.933 -78.407 -16.482 1.00 44.45 N ATOM 875 CA ASP A 58 25.105 -78.458 -17.358 1.00 61.14 C ATOM 876 C ASP A 58 26.386 -78.247 -16.557 1.00 50.21 C ATOM 877 O ASP A 58 27.368 -78.968 -16.734 1.00 33.21 O ATOM 878 CB ASP A 58 24.996 -77.405 -18.469 1.00 0.41 C ATOM 879 CG ASP A 58 26.100 -77.522 -19.513 1.00 35.12 C ATOM 880 OD1 ASP A 58 26.260 -78.614 -20.093 1.00 32.14 O ATOM 881 OD2 ASP A 58 26.777 -76.510 -19.795 1.00 22.10 O ATOM 0 H ASP A 58 23.386 -77.550 -16.559 1.00 44.45 H new ATOM 0 HA ASP A 58 25.142 -79.446 -17.817 1.00 61.14 H new ATOM 0 HB2 ASP A 58 24.028 -77.502 -18.960 1.00 0.41 H new ATOM 0 HB3 ASP A 58 25.029 -76.411 -18.024 1.00 0.41 H new ATOM 886 N ALA A 59 26.361 -77.271 -15.652 1.00 41.11 N ATOM 887 CA ALA A 59 27.535 -76.934 -14.849 1.00 31.13 C ATOM 888 C ALA A 59 27.889 -78.068 -13.887 1.00 41.12 C ATOM 889 O ALA A 59 29.065 -78.349 -13.642 1.00 73.43 O ATOM 890 CB ALA A 59 27.303 -75.639 -14.079 1.00 33.22 C ATOM 0 H ALA A 59 25.540 -76.699 -15.456 1.00 41.11 H new ATOM 0 HA ALA A 59 28.375 -76.791 -15.528 1.00 31.13 H new ATOM 0 HB1 ALA A 59 28.188 -75.404 -13.487 1.00 33.22 H new ATOM 0 HB2 ALA A 59 27.110 -74.828 -14.781 1.00 33.22 H new ATOM 0 HB3 ALA A 59 26.445 -75.758 -13.418 1.00 33.22 H new ATOM 896 N LEU A 60 26.867 -78.710 -13.329 1.00 54.24 N ATOM 897 CA LEU A 60 27.073 -79.813 -12.392 1.00 74.52 C ATOM 898 C LEU A 60 27.071 -81.161 -13.122 1.00 2.20 C ATOM 899 O LEU A 60 27.450 -82.186 -12.557 1.00 5.04 O ATOM 900 CB LEU A 60 25.994 -79.790 -11.296 1.00 10.34 C ATOM 901 CG LEU A 60 26.136 -78.691 -10.221 1.00 60.33 C ATOM 902 CD1 LEU A 60 27.407 -78.889 -9.408 1.00 41.11 C ATOM 903 CD2 LEU A 60 26.110 -77.292 -10.836 1.00 51.52 C ATOM 0 H LEU A 60 25.888 -78.487 -13.508 1.00 54.24 H new ATOM 0 HA LEU A 60 28.049 -79.686 -11.924 1.00 74.52 H new ATOM 0 HB2 LEU A 60 25.022 -79.677 -11.775 1.00 10.34 H new ATOM 0 HB3 LEU A 60 25.992 -80.759 -10.797 1.00 10.34 H new ATOM 0 HG LEU A 60 25.278 -78.778 -9.554 1.00 60.33 H new ATOM 0 HD11 LEU A 60 27.485 -78.103 -8.657 1.00 41.11 H new ATOM 0 HD12 LEU A 60 27.375 -79.860 -8.914 1.00 41.11 H new ATOM 0 HD13 LEU A 60 28.272 -78.846 -10.069 1.00 41.11 H new ATOM 0 HD21 LEU A 60 26.212 -76.546 -10.048 1.00 51.52 H new ATOM 0 HD22 LEU A 60 26.934 -77.190 -11.542 1.00 51.52 H new ATOM 0 HD23 LEU A 60 25.165 -77.141 -11.357 1.00 51.52 H new ATOM 915 N SER A 61 26.637 -81.148 -14.382 1.00 74.52 N ATOM 916 CA SER A 61 26.691 -82.322 -15.248 1.00 3.53 C ATOM 917 C SER A 61 25.765 -83.436 -14.741 1.00 64.03 C ATOM 918 O SER A 61 26.220 -84.529 -14.390 1.00 34.12 O ATOM 919 CB SER A 61 28.137 -82.824 -15.390 1.00 74.53 C ATOM 920 OG SER A 61 29.002 -81.772 -15.796 1.00 63.03 O ATOM 0 H SER A 61 26.238 -80.323 -14.830 1.00 74.52 H new ATOM 0 HA SER A 61 26.334 -82.027 -16.235 1.00 3.53 H new ATOM 0 HB2 SER A 61 28.478 -83.235 -14.440 1.00 74.53 H new ATOM 0 HB3 SER A 61 28.175 -83.633 -16.119 1.00 74.53 H new ATOM 0 HG SER A 61 29.917 -82.114 -15.878 1.00 63.03 H new ATOM 926 N LEU A 62 24.465 -83.144 -14.688 1.00 73.12 N ATOM 927 CA LEU A 62 23.464 -84.144 -14.315 1.00 32.44 C ATOM 928 C LEU A 62 22.850 -84.767 -15.560 1.00 13.42 C ATOM 929 O LEU A 62 22.603 -84.078 -16.555 1.00 54.02 O ATOM 930 CB LEU A 62 22.339 -83.536 -13.450 1.00 62.02 C ATOM 931 CG LEU A 62 22.724 -83.144 -12.015 1.00 31.13 C ATOM 932 CD1 LEU A 62 23.455 -84.289 -11.322 1.00 22.14 C ATOM 933 CD2 LEU A 62 23.557 -81.870 -12.008 1.00 20.31 C ATOM 0 H LEU A 62 24.080 -82.223 -14.899 1.00 73.12 H new ATOM 0 HA LEU A 62 23.976 -84.907 -13.729 1.00 32.44 H new ATOM 0 HB2 LEU A 62 21.958 -82.649 -13.957 1.00 62.02 H new ATOM 0 HB3 LEU A 62 21.519 -84.252 -13.401 1.00 62.02 H new ATOM 0 HG LEU A 62 21.810 -82.945 -11.456 1.00 31.13 H new ATOM 0 HD11 LEU A 62 23.719 -83.991 -10.307 1.00 22.14 H new ATOM 0 HD12 LEU A 62 22.808 -85.165 -11.286 1.00 22.14 H new ATOM 0 HD13 LEU A 62 24.362 -84.530 -11.877 1.00 22.14 H new ATOM 0 HD21 LEU A 62 23.818 -81.612 -10.982 1.00 20.31 H new ATOM 0 HD22 LEU A 62 24.468 -82.028 -12.585 1.00 20.31 H new ATOM 0 HD23 LEU A 62 22.982 -81.057 -12.452 1.00 20.31 H new ATOM 945 N VAL A 63 22.611 -86.070 -15.500 1.00 63.31 N ATOM 946 CA VAL A 63 21.910 -86.779 -16.563 1.00 53.30 C ATOM 947 C VAL A 63 20.559 -87.248 -16.037 1.00 24.01 C ATOM 948 O VAL A 63 20.395 -87.456 -14.834 1.00 52.40 O ATOM 949 CB VAL A 63 22.727 -87.986 -17.099 1.00 11.42 C ATOM 950 CG1 VAL A 63 24.048 -87.514 -17.705 1.00 23.31 C ATOM 951 CG2 VAL A 63 22.968 -89.019 -15.999 1.00 10.23 C ATOM 0 H VAL A 63 22.895 -86.662 -14.719 1.00 63.31 H new ATOM 0 HA VAL A 63 21.772 -86.093 -17.399 1.00 53.30 H new ATOM 0 HB VAL A 63 22.144 -88.468 -17.884 1.00 11.42 H new ATOM 0 HG11 VAL A 63 24.606 -88.374 -18.075 1.00 23.31 H new ATOM 0 HG12 VAL A 63 23.846 -86.830 -18.529 1.00 23.31 H new ATOM 0 HG13 VAL A 63 24.635 -87.001 -16.943 1.00 23.31 H new ATOM 0 HG21 VAL A 63 23.542 -89.853 -16.403 1.00 10.23 H new ATOM 0 HG22 VAL A 63 23.523 -88.558 -15.182 1.00 10.23 H new ATOM 0 HG23 VAL A 63 22.011 -89.384 -15.627 1.00 10.23 H new ATOM 961 N GLY A 64 19.591 -87.378 -16.930 1.00 15.23 N ATOM 962 CA GLY A 64 18.248 -87.755 -16.534 1.00 55.25 C ATOM 963 C GLY A 64 17.224 -87.193 -17.491 1.00 30.41 C ATOM 964 O GLY A 64 17.450 -87.199 -18.707 1.00 63.55 O ATOM 0 H GLY A 64 19.712 -87.228 -17.932 1.00 15.23 H new ATOM 0 HA2 GLY A 64 18.165 -88.841 -16.504 1.00 55.25 H new ATOM 0 HA3 GLY A 64 18.047 -87.392 -15.526 1.00 55.25 H new ATOM 968 N TYR A 65 16.103 -86.698 -16.969 1.00 73.32 N ATOM 969 CA TYR A 65 15.061 -86.132 -17.831 1.00 13.32 C ATOM 970 C TYR A 65 14.031 -85.352 -17.021 1.00 31.43 C ATOM 971 O TYR A 65 13.771 -85.682 -15.873 1.00 30.44 O ATOM 972 CB TYR A 65 14.402 -87.248 -18.676 1.00 12.34 C ATOM 973 CG TYR A 65 12.908 -87.453 -18.471 1.00 12.32 C ATOM 974 CD1 TYR A 65 12.432 -88.299 -17.471 1.00 2.54 C ATOM 975 CD2 TYR A 65 11.978 -86.825 -19.295 1.00 43.24 C ATOM 976 CE1 TYR A 65 11.077 -88.507 -17.299 1.00 14.21 C ATOM 977 CE2 TYR A 65 10.620 -87.026 -19.124 1.00 74.34 C ATOM 978 CZ TYR A 65 10.175 -87.870 -18.125 1.00 4.14 C ATOM 979 OH TYR A 65 8.824 -88.082 -17.957 1.00 22.34 O ATOM 0 H TYR A 65 15.892 -86.676 -15.971 1.00 73.32 H new ATOM 0 HA TYR A 65 15.527 -85.422 -18.514 1.00 13.32 H new ATOM 0 HB2 TYR A 65 14.576 -87.028 -19.729 1.00 12.34 H new ATOM 0 HB3 TYR A 65 14.910 -88.188 -18.458 1.00 12.34 H new ATOM 0 HD1 TYR A 65 13.133 -88.800 -16.820 1.00 2.54 H new ATOM 0 HD2 TYR A 65 12.323 -86.170 -20.081 1.00 43.24 H new ATOM 0 HE1 TYR A 65 10.725 -89.167 -16.520 1.00 14.21 H new ATOM 0 HE2 TYR A 65 9.912 -86.526 -19.768 1.00 74.34 H new ATOM 0 HH TYR A 65 8.638 -88.275 -17.014 1.00 22.34 H new ATOM 989 N VAL A 66 13.468 -84.305 -17.625 1.00 23.54 N ATOM 990 CA VAL A 66 12.429 -83.491 -16.982 1.00 72.34 C ATOM 991 C VAL A 66 11.331 -83.128 -17.981 1.00 10.41 C ATOM 992 O VAL A 66 11.614 -82.914 -19.160 1.00 63.31 O ATOM 993 CB VAL A 66 13.027 -82.201 -16.342 1.00 1.11 C ATOM 994 CG1 VAL A 66 11.967 -81.112 -16.168 1.00 51.44 C ATOM 995 CG2 VAL A 66 13.676 -82.525 -14.992 1.00 12.42 C ATOM 0 H VAL A 66 13.715 -83.997 -18.566 1.00 23.54 H new ATOM 0 HA VAL A 66 11.992 -84.090 -16.183 1.00 72.34 H new ATOM 0 HB VAL A 66 13.788 -81.820 -17.023 1.00 1.11 H new ATOM 0 HG11 VAL A 66 12.422 -80.229 -15.719 1.00 51.44 H new ATOM 0 HG12 VAL A 66 11.551 -80.851 -17.141 1.00 51.44 H new ATOM 0 HG13 VAL A 66 11.171 -81.479 -15.520 1.00 51.44 H new ATOM 0 HG21 VAL A 66 14.089 -81.614 -14.559 1.00 12.42 H new ATOM 0 HG22 VAL A 66 12.926 -82.940 -14.318 1.00 12.42 H new ATOM 0 HG23 VAL A 66 14.475 -83.252 -15.138 1.00 12.42 H new ATOM 1005 N THR A 67 10.090 -83.070 -17.485 1.00 33.35 N ATOM 1006 CA THR A 67 8.908 -82.711 -18.271 1.00 62.00 C ATOM 1007 C THR A 67 7.847 -82.119 -17.343 1.00 43.22 C ATOM 1008 O THR A 67 7.918 -82.287 -16.127 1.00 43.20 O ATOM 1009 CB THR A 67 8.298 -83.930 -19.016 1.00 20.20 C ATOM 1010 OG1 THR A 67 7.145 -83.532 -19.778 1.00 12.03 O ATOM 1011 CG2 THR A 67 7.890 -85.029 -18.047 1.00 52.41 C ATOM 0 H THR A 67 9.877 -83.275 -16.509 1.00 33.35 H new ATOM 0 HA THR A 67 9.223 -81.985 -19.021 1.00 62.00 H new ATOM 0 HB THR A 67 9.069 -84.316 -19.684 1.00 20.20 H new ATOM 0 HG1 THR A 67 6.937 -84.222 -20.442 1.00 12.03 H new ATOM 0 HG21 THR A 67 7.467 -85.866 -18.603 1.00 52.41 H new ATOM 0 HG22 THR A 67 8.765 -85.367 -17.491 1.00 52.41 H new ATOM 0 HG23 THR A 67 7.145 -84.643 -17.351 1.00 52.41 H new ATOM 1019 N ASN A 68 6.881 -81.410 -17.915 1.00 24.14 N ATOM 1020 CA ASN A 68 5.771 -80.858 -17.140 1.00 73.40 C ATOM 1021 C ASN A 68 4.523 -81.716 -17.338 1.00 73.12 C ATOM 1022 O ASN A 68 4.390 -82.406 -18.350 1.00 10.52 O ATOM 1023 CB ASN A 68 5.504 -79.400 -17.553 1.00 71.15 C ATOM 1024 CG ASN A 68 4.321 -78.773 -16.827 1.00 11.14 C ATOM 1025 OD1 ASN A 68 4.559 -78.241 -15.636 1.00 14.14 O flip ATOM 1026 ND2 ASN A 68 3.199 -78.768 -17.330 1.00 71.23 N flip ATOM 0 H ASN A 68 6.842 -81.203 -18.913 1.00 24.14 H new ATOM 0 HA ASN A 68 6.035 -80.867 -16.082 1.00 73.40 H new ATOM 0 HB2 ASN A 68 6.397 -78.806 -17.358 1.00 71.15 H new ATOM 0 HB3 ASN A 68 5.323 -79.362 -18.627 1.00 71.15 H new ATOM 0 HD21 ASN A 68 3.050 -79.186 -18.248 1.00 71.23 H new ATOM 0 HD22 ASN A 68 2.417 -78.346 -16.829 1.00 71.23 H new ATOM 1033 N ASN A 69 3.635 -81.696 -16.351 1.00 74.00 N ATOM 1034 CA ASN A 69 2.376 -82.432 -16.413 1.00 52.24 C ATOM 1035 C ASN A 69 1.207 -81.460 -16.336 1.00 5.25 C ATOM 1036 O ASN A 69 1.354 -80.343 -15.836 1.00 52.52 O ATOM 1037 CB ASN A 69 2.274 -83.454 -15.266 1.00 72.13 C ATOM 1038 CG ASN A 69 3.346 -84.530 -15.329 1.00 72.22 C ATOM 1039 OD1 ASN A 69 4.414 -84.398 -14.730 1.00 2.34 O ATOM 1040 ND2 ASN A 69 3.074 -85.598 -16.065 1.00 31.15 N ATOM 0 H ASN A 69 3.766 -81.171 -15.487 1.00 74.00 H new ATOM 0 HA ASN A 69 2.344 -82.973 -17.359 1.00 52.24 H new ATOM 0 HB2 ASN A 69 2.349 -82.930 -14.313 1.00 72.13 H new ATOM 0 HB3 ASN A 69 1.292 -83.926 -15.294 1.00 72.13 H new ATOM 0 HD21 ASN A 69 3.761 -86.347 -16.150 1.00 31.15 H new ATOM 0 HD22 ASN A 69 2.178 -85.671 -16.546 1.00 31.15 H new ATOM 1047 N GLU A 70 0.044 -81.898 -16.808 1.00 63.52 N ATOM 1048 CA GLU A 70 -1.155 -81.058 -16.843 1.00 54.22 C ATOM 1049 C GLU A 70 -1.526 -80.560 -15.441 1.00 23.41 C ATOM 1050 O GLU A 70 -2.160 -79.515 -15.287 1.00 22.31 O ATOM 1051 CB GLU A 70 -2.318 -81.844 -17.459 1.00 35.24 C ATOM 1052 CG GLU A 70 -3.615 -81.053 -17.586 1.00 73.50 C ATOM 1053 CD GLU A 70 -4.729 -81.871 -18.212 1.00 44.50 C ATOM 1054 OE1 GLU A 70 -5.303 -82.730 -17.513 1.00 22.30 O ATOM 1055 OE2 GLU A 70 -5.029 -81.665 -19.406 1.00 32.11 O ATOM 0 H GLU A 70 -0.097 -82.839 -17.176 1.00 63.52 H new ATOM 0 HA GLU A 70 -0.946 -80.183 -17.459 1.00 54.22 H new ATOM 0 HB2 GLU A 70 -2.021 -82.193 -18.448 1.00 35.24 H new ATOM 0 HB3 GLU A 70 -2.505 -82.729 -16.851 1.00 35.24 H new ATOM 0 HG2 GLU A 70 -3.928 -80.712 -16.599 1.00 73.50 H new ATOM 0 HG3 GLU A 70 -3.438 -80.163 -18.190 1.00 73.50 H new ATOM 1062 N ASP A 71 -1.105 -81.306 -14.422 1.00 53.44 N ATOM 1063 CA ASP A 71 -1.363 -80.938 -13.027 1.00 52.32 C ATOM 1064 C ASP A 71 -0.588 -79.681 -12.627 1.00 60.33 C ATOM 1065 O ASP A 71 -0.783 -79.146 -11.534 1.00 61.33 O ATOM 1066 CB ASP A 71 -0.977 -82.086 -12.084 1.00 72.43 C ATOM 1067 CG ASP A 71 -1.807 -83.339 -12.301 1.00 73.01 C ATOM 1068 OD1 ASP A 71 -2.991 -83.347 -11.907 1.00 23.34 O ATOM 1069 OD2 ASP A 71 -1.277 -84.328 -12.849 1.00 44.11 O ATOM 0 H ASP A 71 -0.581 -82.174 -14.535 1.00 53.44 H new ATOM 0 HA ASP A 71 -2.430 -80.735 -12.940 1.00 52.32 H new ATOM 0 HB2 ASP A 71 0.077 -82.326 -12.226 1.00 72.43 H new ATOM 0 HB3 ASP A 71 -1.092 -81.755 -11.052 1.00 72.43 H new ATOM 1074 N GLY A 72 0.292 -79.220 -13.515 1.00 2.22 N ATOM 1075 CA GLY A 72 1.156 -78.091 -13.208 1.00 24.21 C ATOM 1076 C GLY A 72 2.451 -78.544 -12.564 1.00 64.40 C ATOM 1077 O GLY A 72 3.299 -77.730 -12.193 1.00 24.14 O ATOM 0 H GLY A 72 0.422 -79.612 -14.448 1.00 2.22 H new ATOM 0 HA2 GLY A 72 1.376 -77.540 -14.123 1.00 24.21 H new ATOM 0 HA3 GLY A 72 0.636 -77.404 -12.540 1.00 24.21 H new ATOM 1081 N SER A 73 2.604 -79.858 -12.456 1.00 74.30 N ATOM 1082 CA SER A 73 3.758 -80.453 -11.800 1.00 53.52 C ATOM 1083 C SER A 73 4.867 -80.735 -12.814 1.00 5.24 C ATOM 1084 O SER A 73 4.626 -81.334 -13.859 1.00 20.32 O ATOM 1085 CB SER A 73 3.340 -81.749 -11.087 1.00 23.04 C ATOM 1086 OG SER A 73 4.423 -82.324 -10.381 1.00 33.31 O ATOM 0 H SER A 73 1.935 -80.537 -12.819 1.00 74.30 H new ATOM 0 HA SER A 73 4.144 -79.750 -11.061 1.00 53.52 H new ATOM 0 HB2 SER A 73 2.524 -81.538 -10.396 1.00 23.04 H new ATOM 0 HB3 SER A 73 2.961 -82.462 -11.819 1.00 23.04 H new ATOM 0 HG SER A 73 5.057 -81.622 -10.125 1.00 33.31 H new ATOM 1092 N VAL A 74 6.072 -80.277 -12.504 1.00 2.14 N ATOM 1093 CA VAL A 74 7.258 -80.583 -13.289 1.00 23.14 C ATOM 1094 C VAL A 74 7.930 -81.819 -12.698 1.00 45.15 C ATOM 1095 O VAL A 74 8.400 -81.791 -11.560 1.00 50.12 O ATOM 1096 CB VAL A 74 8.252 -79.398 -13.272 1.00 61.55 C ATOM 1097 CG1 VAL A 74 9.430 -79.660 -14.206 1.00 25.24 C ATOM 1098 CG2 VAL A 74 7.542 -78.096 -13.635 1.00 44.21 C ATOM 0 H VAL A 74 6.254 -79.680 -11.697 1.00 2.14 H new ATOM 0 HA VAL A 74 6.963 -80.766 -14.322 1.00 23.14 H new ATOM 0 HB VAL A 74 8.646 -79.298 -12.261 1.00 61.55 H new ATOM 0 HG11 VAL A 74 10.114 -78.812 -14.176 1.00 25.24 H new ATOM 0 HG12 VAL A 74 9.954 -80.561 -13.887 1.00 25.24 H new ATOM 0 HG13 VAL A 74 9.064 -79.795 -15.224 1.00 25.24 H new ATOM 0 HG21 VAL A 74 8.258 -77.274 -13.618 1.00 44.21 H new ATOM 0 HG22 VAL A 74 7.112 -78.182 -14.633 1.00 44.21 H new ATOM 0 HG23 VAL A 74 6.748 -77.901 -12.914 1.00 44.21 H new ATOM 1108 N SER A 75 7.957 -82.899 -13.461 1.00 24.41 N ATOM 1109 CA SER A 75 8.455 -84.178 -12.968 1.00 33.53 C ATOM 1110 C SER A 75 9.617 -84.677 -13.836 1.00 25.55 C ATOM 1111 O SER A 75 9.751 -84.278 -14.995 1.00 44.43 O ATOM 1112 CB SER A 75 7.309 -85.194 -12.969 1.00 45.42 C ATOM 1113 OG SER A 75 6.139 -84.647 -12.374 1.00 50.11 O ATOM 0 H SER A 75 7.639 -82.918 -14.430 1.00 24.41 H new ATOM 0 HA SER A 75 8.828 -84.052 -11.952 1.00 33.53 H new ATOM 0 HB2 SER A 75 7.091 -85.500 -13.992 1.00 45.42 H new ATOM 0 HB3 SER A 75 7.612 -86.089 -12.426 1.00 45.42 H new ATOM 0 HG SER A 75 5.452 -84.520 -13.061 1.00 50.11 H new ATOM 1119 N GLY A 76 10.452 -85.545 -13.270 1.00 32.44 N ATOM 1120 CA GLY A 76 11.583 -86.085 -13.998 1.00 51.54 C ATOM 1121 C GLY A 76 12.497 -86.919 -13.116 1.00 43.42 C ATOM 1122 O GLY A 76 12.098 -87.349 -12.033 1.00 53.55 O ATOM 0 H GLY A 76 10.362 -85.885 -12.312 1.00 32.44 H new ATOM 0 HA2 GLY A 76 11.221 -86.698 -14.823 1.00 51.54 H new ATOM 0 HA3 GLY A 76 12.154 -85.266 -14.436 1.00 51.54 H new ATOM 1126 N VAL A 77 13.727 -87.138 -13.577 1.00 42.05 N ATOM 1127 CA VAL A 77 14.711 -87.950 -12.860 1.00 43.44 C ATOM 1128 C VAL A 77 16.103 -87.313 -12.958 1.00 74.14 C ATOM 1129 O VAL A 77 16.505 -86.864 -14.041 1.00 42.33 O ATOM 1130 CB VAL A 77 14.784 -89.396 -13.432 1.00 53.04 C ATOM 1131 CG1 VAL A 77 15.787 -90.246 -12.653 1.00 73.25 C ATOM 1132 CG2 VAL A 77 13.407 -90.060 -13.439 1.00 44.22 C ATOM 0 H VAL A 77 14.071 -86.758 -14.459 1.00 42.05 H new ATOM 0 HA VAL A 77 14.392 -87.997 -11.819 1.00 43.44 H new ATOM 0 HB VAL A 77 15.128 -89.323 -14.464 1.00 53.04 H new ATOM 0 HG11 VAL A 77 15.817 -91.251 -13.074 1.00 73.25 H new ATOM 0 HG12 VAL A 77 16.777 -89.794 -12.721 1.00 73.25 H new ATOM 0 HG13 VAL A 77 15.484 -90.300 -11.607 1.00 73.25 H new ATOM 0 HG21 VAL A 77 13.491 -91.068 -13.844 1.00 44.22 H new ATOM 0 HG22 VAL A 77 13.022 -90.109 -12.421 1.00 44.22 H new ATOM 0 HG23 VAL A 77 12.725 -89.477 -14.057 1.00 44.22 H new ATOM 1142 N VAL A 78 16.815 -87.267 -11.823 1.00 11.12 N ATOM 1143 CA VAL A 78 18.207 -86.813 -11.770 1.00 13.11 C ATOM 1144 C VAL A 78 19.120 -87.992 -11.452 1.00 3.40 C ATOM 1145 O VAL A 78 18.825 -88.789 -10.551 1.00 63.53 O ATOM 1146 CB VAL A 78 18.428 -85.723 -10.688 1.00 55.53 C ATOM 1147 CG1 VAL A 78 19.910 -85.380 -10.549 1.00 52.34 C ATOM 1148 CG2 VAL A 78 17.621 -84.471 -10.997 1.00 23.42 C ATOM 0 H VAL A 78 16.439 -87.544 -10.916 1.00 11.12 H new ATOM 0 HA VAL A 78 18.441 -86.386 -12.745 1.00 13.11 H new ATOM 0 HB VAL A 78 18.079 -86.128 -9.738 1.00 55.53 H new ATOM 0 HG11 VAL A 78 20.036 -84.614 -9.784 1.00 52.34 H new ATOM 0 HG12 VAL A 78 20.465 -86.273 -10.262 1.00 52.34 H new ATOM 0 HG13 VAL A 78 20.288 -85.008 -11.501 1.00 52.34 H new ATOM 0 HG21 VAL A 78 17.796 -83.725 -10.222 1.00 23.42 H new ATOM 0 HG22 VAL A 78 17.928 -84.070 -11.963 1.00 23.42 H new ATOM 0 HG23 VAL A 78 16.560 -84.720 -11.028 1.00 23.42 H new ATOM 1158 N GLN A 79 20.220 -88.100 -12.192 1.00 61.04 N ATOM 1159 CA GLN A 79 21.181 -89.180 -12.004 1.00 72.34 C ATOM 1160 C GLN A 79 22.605 -88.626 -12.048 1.00 51.25 C ATOM 1161 O GLN A 79 22.858 -87.592 -12.673 1.00 1.41 O ATOM 1162 CB GLN A 79 21.009 -90.246 -13.097 1.00 75.34 C ATOM 1163 CG GLN A 79 19.576 -90.404 -13.597 1.00 65.40 C ATOM 1164 CD GLN A 79 19.439 -91.466 -14.667 1.00 13.34 C ATOM 1165 OE1 GLN A 79 18.641 -91.334 -15.590 1.00 12.03 O ATOM 1166 NE2 GLN A 79 20.181 -92.553 -14.521 1.00 41.24 N ATOM 0 H GLN A 79 20.468 -87.445 -12.934 1.00 61.04 H new ATOM 0 HA GLN A 79 21.001 -89.638 -11.031 1.00 72.34 H new ATOM 0 HB2 GLN A 79 21.650 -89.992 -13.941 1.00 75.34 H new ATOM 0 HB3 GLN A 79 21.355 -91.205 -12.711 1.00 75.34 H new ATOM 0 HG2 GLN A 79 18.929 -90.656 -12.757 1.00 65.40 H new ATOM 0 HG3 GLN A 79 19.227 -89.450 -13.992 1.00 65.40 H new ATOM 0 HE21 GLN A 79 20.833 -92.624 -13.740 1.00 41.24 H new ATOM 0 HE22 GLN A 79 20.101 -93.319 -15.190 1.00 41.24 H new ATOM 1175 N GLY A 80 23.525 -89.318 -11.381 1.00 73.20 N ATOM 1176 CA GLY A 80 24.923 -88.919 -11.380 1.00 70.11 C ATOM 1177 C GLY A 80 25.550 -89.067 -10.010 1.00 45.11 C ATOM 1178 O GLY A 80 25.049 -89.832 -9.180 1.00 30.00 O ATOM 0 H GLY A 80 23.324 -90.156 -10.836 1.00 73.20 H new ATOM 0 HA2 GLY A 80 25.474 -89.525 -12.099 1.00 70.11 H new ATOM 0 HA3 GLY A 80 25.005 -87.882 -11.707 1.00 70.11 H new ATOM 1182 N PRO A 81 26.662 -88.362 -9.745 1.00 21.24 N ATOM 1183 CA PRO A 81 27.288 -88.359 -8.422 1.00 24.25 C ATOM 1184 C PRO A 81 26.391 -87.662 -7.400 1.00 43.11 C ATOM 1185 O PRO A 81 25.860 -86.579 -7.667 1.00 61.12 O ATOM 1186 CB PRO A 81 28.596 -87.581 -8.639 1.00 14.12 C ATOM 1187 CG PRO A 81 28.343 -86.737 -9.841 1.00 1.43 C ATOM 1188 CD PRO A 81 27.395 -87.519 -10.710 1.00 73.32 C ATOM 0 HA PRO A 81 27.459 -89.361 -8.029 1.00 24.25 H new ATOM 0 HB2 PRO A 81 28.841 -86.969 -7.771 1.00 14.12 H new ATOM 0 HB3 PRO A 81 29.436 -88.257 -8.800 1.00 14.12 H new ATOM 0 HG2 PRO A 81 27.911 -85.777 -9.559 1.00 1.43 H new ATOM 0 HG3 PRO A 81 29.272 -86.525 -10.371 1.00 1.43 H new ATOM 0 HD2 PRO A 81 26.722 -86.863 -11.262 1.00 73.32 H new ATOM 0 HD3 PRO A 81 27.928 -88.121 -11.446 1.00 73.32 H new ATOM 1196 N LYS A 82 26.237 -88.274 -6.226 1.00 34.24 N ATOM 1197 CA LYS A 82 25.296 -87.790 -5.213 1.00 65.22 C ATOM 1198 C LYS A 82 25.570 -86.334 -4.818 1.00 10.03 C ATOM 1199 O LYS A 82 24.685 -85.642 -4.310 1.00 13.55 O ATOM 1200 CB LYS A 82 25.283 -88.724 -3.979 1.00 54.13 C ATOM 1201 CG LYS A 82 26.659 -89.140 -3.437 1.00 14.43 C ATOM 1202 CD LYS A 82 27.403 -87.993 -2.754 1.00 71.14 C ATOM 1203 CE LYS A 82 28.626 -88.484 -1.981 1.00 51.01 C ATOM 1204 NZ LYS A 82 29.614 -89.184 -2.850 1.00 4.33 N ATOM 0 H LYS A 82 26.754 -89.109 -5.951 1.00 34.24 H new ATOM 0 HA LYS A 82 24.301 -87.809 -5.658 1.00 65.22 H new ATOM 0 HB2 LYS A 82 24.733 -88.229 -3.179 1.00 54.13 H new ATOM 0 HB3 LYS A 82 24.728 -89.626 -4.236 1.00 54.13 H new ATOM 0 HG2 LYS A 82 26.532 -89.957 -2.727 1.00 14.43 H new ATOM 0 HG3 LYS A 82 27.266 -89.522 -4.258 1.00 14.43 H new ATOM 0 HD2 LYS A 82 27.716 -87.266 -3.504 1.00 71.14 H new ATOM 0 HD3 LYS A 82 26.727 -87.477 -2.073 1.00 71.14 H new ATOM 0 HE2 LYS A 82 29.110 -87.635 -1.498 1.00 51.01 H new ATOM 0 HE3 LYS A 82 28.303 -89.159 -1.189 1.00 51.01 H new ATOM 0 HZ1 LYS A 82 30.438 -89.466 -2.282 1.00 4.33 H new ATOM 0 HZ2 LYS A 82 29.174 -90.030 -3.265 1.00 4.33 H new ATOM 0 HZ3 LYS A 82 29.921 -88.545 -3.611 1.00 4.33 H new ATOM 1218 N GLU A 83 26.789 -85.872 -5.077 1.00 45.34 N ATOM 1219 CA GLU A 83 27.161 -84.483 -4.812 1.00 53.14 C ATOM 1220 C GLU A 83 26.395 -83.552 -5.749 1.00 41.52 C ATOM 1221 O GLU A 83 25.741 -82.594 -5.323 1.00 1.31 O ATOM 1222 CB GLU A 83 28.669 -84.293 -5.025 1.00 53.44 C ATOM 1223 CG GLU A 83 29.529 -85.281 -4.257 1.00 34.25 C ATOM 1224 CD GLU A 83 31.008 -85.138 -4.577 1.00 42.22 C ATOM 1225 OE1 GLU A 83 31.455 -85.696 -5.604 1.00 53.32 O ATOM 1226 OE2 GLU A 83 31.725 -84.470 -3.805 1.00 25.22 O ATOM 0 H GLU A 83 27.539 -86.439 -5.471 1.00 45.34 H new ATOM 0 HA GLU A 83 26.910 -84.243 -3.779 1.00 53.14 H new ATOM 0 HB2 GLU A 83 28.890 -84.384 -6.088 1.00 53.44 H new ATOM 0 HB3 GLU A 83 28.943 -83.281 -4.728 1.00 53.44 H new ATOM 0 HG2 GLU A 83 29.376 -85.136 -3.188 1.00 34.25 H new ATOM 0 HG3 GLU A 83 29.207 -86.296 -4.490 1.00 34.25 H new ATOM 1233 N GLN A 84 26.469 -83.858 -7.036 1.00 71.32 N ATOM 1234 CA GLN A 84 25.838 -83.038 -8.061 1.00 73.41 C ATOM 1235 C GLN A 84 24.322 -83.236 -8.045 1.00 4.41 C ATOM 1236 O GLN A 84 23.565 -82.324 -8.380 1.00 35.12 O ATOM 1237 CB GLN A 84 26.437 -83.354 -9.437 1.00 70.43 C ATOM 1238 CG GLN A 84 27.827 -82.748 -9.663 1.00 43.51 C ATOM 1239 CD GLN A 84 28.836 -83.094 -8.576 1.00 53.33 C ATOM 1240 OE1 GLN A 84 29.527 -84.108 -8.650 1.00 64.14 O ATOM 1241 NE2 GLN A 84 28.931 -82.251 -7.558 1.00 5.13 N ATOM 0 H GLN A 84 26.963 -84.674 -7.397 1.00 71.32 H new ATOM 0 HA GLN A 84 26.034 -81.987 -7.847 1.00 73.41 H new ATOM 0 HB2 GLN A 84 26.499 -84.436 -9.556 1.00 70.43 H new ATOM 0 HB3 GLN A 84 25.761 -82.987 -10.210 1.00 70.43 H new ATOM 0 HG2 GLN A 84 28.211 -83.092 -10.624 1.00 43.51 H new ATOM 0 HG3 GLN A 84 27.734 -81.664 -9.727 1.00 43.51 H new ATOM 0 HE21 GLN A 84 28.342 -81.419 -7.528 1.00 5.13 H new ATOM 0 HE22 GLN A 84 29.593 -82.434 -6.804 1.00 5.13 H new ATOM 1250 N VAL A 85 23.885 -84.427 -7.644 1.00 33.13 N ATOM 1251 CA VAL A 85 22.468 -84.679 -7.388 1.00 22.34 C ATOM 1252 C VAL A 85 21.995 -83.766 -6.249 1.00 73.43 C ATOM 1253 O VAL A 85 20.911 -83.185 -6.315 1.00 53.31 O ATOM 1254 CB VAL A 85 22.217 -86.166 -7.017 1.00 44.11 C ATOM 1255 CG1 VAL A 85 20.745 -86.415 -6.689 1.00 71.00 C ATOM 1256 CG2 VAL A 85 22.679 -87.085 -8.147 1.00 25.24 C ATOM 0 H VAL A 85 24.491 -85.233 -7.489 1.00 33.13 H new ATOM 0 HA VAL A 85 21.905 -84.465 -8.296 1.00 22.34 H new ATOM 0 HB VAL A 85 22.800 -86.392 -6.124 1.00 44.11 H new ATOM 0 HG11 VAL A 85 20.602 -87.465 -6.433 1.00 71.00 H new ATOM 0 HG12 VAL A 85 20.450 -85.792 -5.844 1.00 71.00 H new ATOM 0 HG13 VAL A 85 20.132 -86.166 -7.555 1.00 71.00 H new ATOM 0 HG21 VAL A 85 22.496 -88.123 -7.870 1.00 25.24 H new ATOM 0 HG22 VAL A 85 22.127 -86.849 -9.057 1.00 25.24 H new ATOM 0 HG23 VAL A 85 23.745 -86.939 -8.322 1.00 25.24 H new ATOM 1266 N ASP A 86 22.840 -83.628 -5.218 1.00 15.30 N ATOM 1267 CA ASP A 86 22.569 -82.716 -4.106 1.00 63.23 C ATOM 1268 C ASP A 86 22.548 -81.266 -4.592 1.00 64.31 C ATOM 1269 O ASP A 86 21.782 -80.438 -4.091 1.00 72.04 O ATOM 1270 CB ASP A 86 23.618 -82.876 -2.996 1.00 35.40 C ATOM 1271 CG ASP A 86 23.398 -81.908 -1.839 1.00 14.31 C ATOM 1272 OD1 ASP A 86 22.611 -82.233 -0.923 1.00 61.35 O ATOM 1273 OD2 ASP A 86 24.013 -80.820 -1.836 1.00 32.10 O ATOM 0 H ASP A 86 23.719 -84.139 -5.134 1.00 15.30 H new ATOM 0 HA ASP A 86 21.590 -82.969 -3.699 1.00 63.23 H new ATOM 0 HB2 ASP A 86 23.591 -83.899 -2.620 1.00 35.40 H new ATOM 0 HB3 ASP A 86 24.612 -82.717 -3.414 1.00 35.40 H new ATOM 1278 N ALA A 87 23.403 -80.958 -5.560 1.00 21.34 N ATOM 1279 CA ALA A 87 23.414 -79.633 -6.175 1.00 34.53 C ATOM 1280 C ALA A 87 22.093 -79.359 -6.903 1.00 20.20 C ATOM 1281 O ALA A 87 21.536 -78.254 -6.825 1.00 62.15 O ATOM 1282 CB ALA A 87 24.589 -79.508 -7.133 1.00 10.13 C ATOM 0 H ALA A 87 24.096 -81.605 -5.936 1.00 21.34 H new ATOM 0 HA ALA A 87 23.526 -78.888 -5.387 1.00 34.53 H new ATOM 0 HB1 ALA A 87 24.586 -78.516 -7.585 1.00 10.13 H new ATOM 0 HB2 ALA A 87 25.521 -79.655 -6.587 1.00 10.13 H new ATOM 0 HB3 ALA A 87 24.503 -80.263 -7.915 1.00 10.13 H new ATOM 1288 N PHE A 88 21.590 -80.371 -7.601 1.00 23.24 N ATOM 1289 CA PHE A 88 20.349 -80.234 -8.350 1.00 53.22 C ATOM 1290 C PHE A 88 19.165 -80.071 -7.396 1.00 41.43 C ATOM 1291 O PHE A 88 18.288 -79.241 -7.631 1.00 24.23 O ATOM 1292 CB PHE A 88 20.131 -81.437 -9.277 1.00 13.44 C ATOM 1293 CG PHE A 88 19.225 -81.128 -10.446 1.00 60.45 C ATOM 1294 CD1 PHE A 88 17.844 -81.143 -10.305 1.00 41.43 C ATOM 1295 CD2 PHE A 88 19.763 -80.814 -11.685 1.00 2.04 C ATOM 1296 CE1 PHE A 88 17.022 -80.853 -11.377 1.00 43.45 C ATOM 1297 CE2 PHE A 88 18.946 -80.523 -12.758 1.00 65.45 C ATOM 1298 CZ PHE A 88 17.574 -80.542 -12.605 1.00 72.11 C ATOM 0 H PHE A 88 22.022 -81.293 -7.663 1.00 23.24 H new ATOM 0 HA PHE A 88 20.423 -79.340 -8.969 1.00 53.22 H new ATOM 0 HB2 PHE A 88 21.096 -81.778 -9.653 1.00 13.44 H new ATOM 0 HB3 PHE A 88 19.705 -82.259 -8.702 1.00 13.44 H new ATOM 0 HD1 PHE A 88 17.407 -81.384 -9.347 1.00 41.43 H new ATOM 0 HD2 PHE A 88 20.835 -80.797 -11.812 1.00 2.04 H new ATOM 0 HE1 PHE A 88 15.949 -80.869 -11.255 1.00 43.45 H new ATOM 0 HE2 PHE A 88 19.379 -80.280 -13.717 1.00 65.45 H new ATOM 0 HZ PHE A 88 16.933 -80.314 -13.444 1.00 72.11 H new ATOM 1308 N VAL A 89 19.143 -80.858 -6.316 1.00 5.13 N ATOM 1309 CA VAL A 89 18.094 -80.724 -5.303 1.00 63.22 C ATOM 1310 C VAL A 89 18.189 -79.354 -4.629 1.00 22.42 C ATOM 1311 O VAL A 89 17.172 -78.758 -4.273 1.00 63.11 O ATOM 1312 CB VAL A 89 18.107 -81.863 -4.243 1.00 62.24 C ATOM 1313 CG1 VAL A 89 19.278 -81.735 -3.280 1.00 41.30 C ATOM 1314 CG2 VAL A 89 16.781 -81.910 -3.486 1.00 71.34 C ATOM 0 H VAL A 89 19.831 -81.586 -6.123 1.00 5.13 H new ATOM 0 HA VAL A 89 17.141 -80.811 -5.824 1.00 63.22 H new ATOM 0 HB VAL A 89 18.235 -82.804 -4.779 1.00 62.24 H new ATOM 0 HG11 VAL A 89 19.246 -82.551 -2.558 1.00 41.30 H new ATOM 0 HG12 VAL A 89 20.214 -81.779 -3.837 1.00 41.30 H new ATOM 0 HG13 VAL A 89 19.214 -80.783 -2.754 1.00 41.30 H new ATOM 0 HG21 VAL A 89 16.811 -82.713 -2.750 1.00 71.34 H new ATOM 0 HG22 VAL A 89 16.617 -80.959 -2.979 1.00 71.34 H new ATOM 0 HG23 VAL A 89 15.967 -82.092 -4.188 1.00 71.34 H new ATOM 1324 N LYS A 90 19.423 -78.858 -4.468 1.00 72.24 N ATOM 1325 CA LYS A 90 19.651 -77.481 -4.021 1.00 63.21 C ATOM 1326 C LYS A 90 18.880 -76.529 -4.926 1.00 31.12 C ATOM 1327 O LYS A 90 18.081 -75.715 -4.457 1.00 14.12 O ATOM 1328 CB LYS A 90 21.155 -77.131 -4.066 1.00 12.24 C ATOM 1329 CG LYS A 90 21.453 -75.629 -4.158 1.00 73.32 C ATOM 1330 CD LYS A 90 22.943 -75.332 -4.351 1.00 40.24 C ATOM 1331 CE LYS A 90 23.524 -76.011 -5.592 1.00 1.53 C ATOM 1332 NZ LYS A 90 22.805 -75.639 -6.843 1.00 60.33 N ATOM 0 H LYS A 90 20.276 -79.390 -4.641 1.00 72.24 H new ATOM 0 HA LYS A 90 19.305 -77.383 -2.992 1.00 63.21 H new ATOM 0 HB2 LYS A 90 21.636 -77.530 -3.173 1.00 12.24 H new ATOM 0 HB3 LYS A 90 21.607 -77.632 -4.922 1.00 12.24 H new ATOM 0 HG2 LYS A 90 20.891 -75.202 -4.989 1.00 73.32 H new ATOM 0 HG3 LYS A 90 21.103 -75.137 -3.250 1.00 73.32 H new ATOM 0 HD2 LYS A 90 23.087 -74.254 -4.430 1.00 40.24 H new ATOM 0 HD3 LYS A 90 23.492 -75.663 -3.470 1.00 40.24 H new ATOM 0 HE2 LYS A 90 24.576 -75.742 -5.689 1.00 1.53 H new ATOM 0 HE3 LYS A 90 23.482 -77.092 -5.462 1.00 1.53 H new ATOM 0 HZ1 LYS A 90 23.370 -75.927 -7.667 1.00 60.33 H new ATOM 0 HZ2 LYS A 90 21.883 -76.120 -6.870 1.00 60.33 H new ATOM 0 HZ3 LYS A 90 22.659 -74.610 -6.866 1.00 60.33 H new ATOM 1346 N TYR A 91 19.109 -76.665 -6.227 1.00 10.11 N ATOM 1347 CA TYR A 91 18.412 -75.853 -7.215 1.00 12.44 C ATOM 1348 C TYR A 91 16.904 -76.060 -7.120 1.00 44.40 C ATOM 1349 O TYR A 91 16.141 -75.110 -7.230 1.00 2.03 O ATOM 1350 CB TYR A 91 18.906 -76.189 -8.626 1.00 54.24 C ATOM 1351 CG TYR A 91 18.003 -75.675 -9.733 1.00 52.31 C ATOM 1352 CD1 TYR A 91 17.948 -74.320 -10.054 1.00 71.31 C ATOM 1353 CD2 TYR A 91 17.195 -76.550 -10.446 1.00 52.30 C ATOM 1354 CE1 TYR A 91 17.112 -73.859 -11.056 1.00 23.41 C ATOM 1355 CE2 TYR A 91 16.363 -76.097 -11.447 1.00 24.51 C ATOM 1356 CZ TYR A 91 16.321 -74.751 -11.748 1.00 4.44 C ATOM 1357 OH TYR A 91 15.483 -74.298 -12.747 1.00 53.33 O ATOM 0 H TYR A 91 19.773 -77.331 -6.622 1.00 10.11 H new ATOM 0 HA TYR A 91 18.628 -74.805 -7.008 1.00 12.44 H new ATOM 0 HB2 TYR A 91 19.903 -75.770 -8.760 1.00 54.24 H new ATOM 0 HB3 TYR A 91 18.999 -77.271 -8.720 1.00 54.24 H new ATOM 0 HD1 TYR A 91 18.567 -73.619 -9.513 1.00 71.31 H new ATOM 0 HD2 TYR A 91 17.219 -77.604 -10.212 1.00 52.30 H new ATOM 0 HE1 TYR A 91 17.080 -72.806 -11.294 1.00 23.41 H new ATOM 0 HE2 TYR A 91 15.745 -76.794 -11.994 1.00 24.51 H new ATOM 0 HH TYR A 91 15.512 -74.919 -13.505 1.00 53.33 H new ATOM 1367 N LEU A 92 16.485 -77.300 -6.902 1.00 51.34 N ATOM 1368 CA LEU A 92 15.064 -77.642 -6.862 1.00 60.14 C ATOM 1369 C LEU A 92 14.383 -76.958 -5.670 1.00 5.34 C ATOM 1370 O LEU A 92 13.273 -76.444 -5.792 1.00 21.55 O ATOM 1371 CB LEU A 92 14.880 -79.172 -6.792 1.00 42.10 C ATOM 1372 CG LEU A 92 13.728 -79.741 -7.645 1.00 14.12 C ATOM 1373 CD1 LEU A 92 12.406 -79.062 -7.315 1.00 1.11 C ATOM 1374 CD2 LEU A 92 14.048 -79.609 -9.135 1.00 4.50 C ATOM 0 H LEU A 92 17.111 -78.091 -6.749 1.00 51.34 H new ATOM 0 HA LEU A 92 14.594 -77.283 -7.777 1.00 60.14 H new ATOM 0 HB2 LEU A 92 15.810 -79.647 -7.105 1.00 42.10 H new ATOM 0 HB3 LEU A 92 14.713 -79.453 -5.752 1.00 42.10 H new ATOM 0 HG LEU A 92 13.625 -80.799 -7.405 1.00 14.12 H new ATOM 0 HD11 LEU A 92 11.615 -79.486 -7.933 1.00 1.11 H new ATOM 0 HD12 LEU A 92 12.168 -79.220 -6.263 1.00 1.11 H new ATOM 0 HD13 LEU A 92 12.487 -77.993 -7.512 1.00 1.11 H new ATOM 0 HD21 LEU A 92 13.224 -80.016 -9.721 1.00 4.50 H new ATOM 0 HD22 LEU A 92 14.187 -78.557 -9.385 1.00 4.50 H new ATOM 0 HD23 LEU A 92 14.961 -80.160 -9.361 1.00 4.50 H new ATOM 1386 N HIS A 93 15.061 -76.943 -4.525 1.00 5.42 N ATOM 1387 CA HIS A 93 14.547 -76.267 -3.332 1.00 23.34 C ATOM 1388 C HIS A 93 14.385 -74.770 -3.592 1.00 11.23 C ATOM 1389 O HIS A 93 13.514 -74.114 -3.012 1.00 14.15 O ATOM 1390 CB HIS A 93 15.472 -76.492 -2.128 1.00 35.40 C ATOM 1391 CG HIS A 93 15.374 -77.860 -1.525 1.00 30.45 C ATOM 1392 ND1 HIS A 93 15.701 -78.125 -0.215 1.00 2.31 N ATOM 1393 CD2 HIS A 93 14.974 -79.040 -2.057 1.00 73.34 C ATOM 1394 CE1 HIS A 93 15.512 -79.406 0.033 1.00 65.23 C ATOM 1395 NE2 HIS A 93 15.068 -79.983 -1.065 1.00 2.30 N ATOM 0 H HIS A 93 15.968 -77.391 -4.396 1.00 5.42 H new ATOM 0 HA HIS A 93 13.571 -76.695 -3.101 1.00 23.34 H new ATOM 0 HB2 HIS A 93 16.502 -76.317 -2.438 1.00 35.40 H new ATOM 0 HB3 HIS A 93 15.239 -75.752 -1.362 1.00 35.40 H new ATOM 0 HD2 HIS A 93 14.643 -79.207 -3.071 1.00 73.34 H new ATOM 0 HE1 HIS A 93 15.691 -79.899 0.977 1.00 65.23 H new ATOM 0 HE2 HIS A 93 14.832 -80.971 -1.162 1.00 2.30 H new ATOM 1404 N LYS A 94 15.250 -74.238 -4.450 1.00 64.43 N ATOM 1405 CA LYS A 94 15.160 -72.846 -4.884 1.00 13.01 C ATOM 1406 C LYS A 94 14.210 -72.723 -6.073 1.00 4.10 C ATOM 1407 O LYS A 94 13.641 -71.656 -6.319 1.00 53.20 O ATOM 1408 CB LYS A 94 16.556 -72.332 -5.280 1.00 13.44 C ATOM 1409 CG LYS A 94 17.541 -72.268 -4.115 1.00 34.11 C ATOM 1410 CD LYS A 94 17.183 -71.167 -3.116 1.00 31.12 C ATOM 1411 CE LYS A 94 17.275 -69.780 -3.746 1.00 75.41 C ATOM 1412 NZ LYS A 94 16.937 -68.704 -2.780 1.00 1.31 N ATOM 0 H LYS A 94 16.028 -74.754 -4.862 1.00 64.43 H new ATOM 0 HA LYS A 94 14.774 -72.246 -4.060 1.00 13.01 H new ATOM 0 HB2 LYS A 94 16.965 -72.980 -6.055 1.00 13.44 H new ATOM 0 HB3 LYS A 94 16.457 -71.338 -5.715 1.00 13.44 H new ATOM 0 HG2 LYS A 94 17.558 -73.230 -3.602 1.00 34.11 H new ATOM 0 HG3 LYS A 94 18.546 -72.094 -4.500 1.00 34.11 H new ATOM 0 HD2 LYS A 94 16.172 -71.330 -2.742 1.00 31.12 H new ATOM 0 HD3 LYS A 94 17.853 -71.222 -2.258 1.00 31.12 H new ATOM 0 HE2 LYS A 94 18.284 -69.621 -4.126 1.00 75.41 H new ATOM 0 HE3 LYS A 94 16.600 -69.725 -4.600 1.00 75.41 H new ATOM 0 HZ1 LYS A 94 17.012 -67.779 -3.250 1.00 1.31 H new ATOM 0 HZ2 LYS A 94 15.965 -68.839 -2.436 1.00 1.31 H new ATOM 0 HZ3 LYS A 94 17.597 -68.739 -1.977 1.00 1.31 H new ATOM 1426 N GLY A 95 14.035 -73.833 -6.785 1.00 31.54 N ATOM 1427 CA GLY A 95 13.303 -73.828 -8.037 1.00 21.24 C ATOM 1428 C GLY A 95 13.908 -72.843 -9.017 1.00 10.52 C ATOM 1429 O GLY A 95 15.076 -72.467 -8.886 1.00 3.03 O ATOM 0 H GLY A 95 14.394 -74.748 -6.511 1.00 31.54 H new ATOM 0 HA2 GLY A 95 13.310 -74.828 -8.470 1.00 21.24 H new ATOM 0 HA3 GLY A 95 12.261 -73.568 -7.852 1.00 21.24 H new ATOM 1433 N SER A 96 13.140 -72.431 -10.006 1.00 75.45 N ATOM 1434 CA SER A 96 13.545 -71.319 -10.839 1.00 64.44 C ATOM 1435 C SER A 96 13.348 -70.034 -10.034 1.00 73.22 C ATOM 1436 O SER A 96 12.222 -69.716 -9.658 1.00 41.20 O ATOM 1437 CB SER A 96 12.728 -71.304 -12.130 1.00 73.31 C ATOM 1438 OG SER A 96 12.925 -72.508 -12.855 1.00 75.44 O ATOM 0 H SER A 96 12.241 -72.846 -10.250 1.00 75.45 H new ATOM 0 HA SER A 96 14.593 -71.410 -11.125 1.00 64.44 H new ATOM 0 HB2 SER A 96 11.670 -71.181 -11.897 1.00 73.31 H new ATOM 0 HB3 SER A 96 13.020 -70.451 -12.743 1.00 73.31 H new ATOM 0 HG SER A 96 13.816 -72.866 -12.658 1.00 75.44 H new ATOM 1444 N PRO A 97 14.435 -69.280 -9.764 1.00 15.32 N ATOM 1445 CA PRO A 97 14.423 -68.154 -8.799 1.00 63.34 C ATOM 1446 C PRO A 97 13.492 -66.997 -9.185 1.00 3.15 C ATOM 1447 O PRO A 97 13.530 -65.933 -8.563 1.00 13.01 O ATOM 1448 CB PRO A 97 15.889 -67.687 -8.780 1.00 53.52 C ATOM 1449 CG PRO A 97 16.459 -68.159 -10.077 1.00 13.42 C ATOM 1450 CD PRO A 97 15.768 -69.459 -10.373 1.00 51.42 C ATOM 0 HA PRO A 97 14.038 -68.478 -7.832 1.00 63.34 H new ATOM 0 HB2 PRO A 97 15.957 -66.603 -8.690 1.00 53.52 H new ATOM 0 HB3 PRO A 97 16.428 -68.112 -7.933 1.00 53.52 H new ATOM 0 HG2 PRO A 97 16.283 -67.432 -10.870 1.00 13.42 H new ATOM 0 HG3 PRO A 97 17.538 -68.296 -10.004 1.00 13.42 H new ATOM 0 HD2 PRO A 97 15.699 -69.643 -11.445 1.00 51.42 H new ATOM 0 HD3 PRO A 97 16.299 -70.305 -9.938 1.00 51.42 H new ATOM 1458 N LYS A 98 12.667 -67.204 -10.204 1.00 53.54 N ATOM 1459 CA LYS A 98 11.692 -66.210 -10.634 1.00 24.34 C ATOM 1460 C LYS A 98 10.270 -66.778 -10.503 1.00 74.31 C ATOM 1461 O LYS A 98 9.296 -66.032 -10.374 1.00 21.32 O ATOM 1462 CB LYS A 98 11.982 -65.794 -12.084 1.00 51.22 C ATOM 1463 CG LYS A 98 11.288 -64.503 -12.510 1.00 43.41 C ATOM 1464 CD LYS A 98 11.784 -63.300 -11.707 1.00 31.02 C ATOM 1465 CE LYS A 98 11.187 -61.993 -12.210 1.00 2.21 C ATOM 1466 NZ LYS A 98 11.498 -61.763 -13.642 1.00 75.23 N ATOM 0 H LYS A 98 12.655 -68.063 -10.754 1.00 53.54 H new ATOM 0 HA LYS A 98 11.768 -65.328 -9.998 1.00 24.34 H new ATOM 0 HB2 LYS A 98 13.058 -65.674 -12.208 1.00 51.22 H new ATOM 0 HB3 LYS A 98 11.672 -66.598 -12.751 1.00 51.22 H new ATOM 0 HG2 LYS A 98 11.464 -64.329 -13.572 1.00 43.41 H new ATOM 0 HG3 LYS A 98 10.211 -64.609 -12.379 1.00 43.41 H new ATOM 0 HD2 LYS A 98 11.528 -63.435 -10.656 1.00 31.02 H new ATOM 0 HD3 LYS A 98 12.871 -63.248 -11.766 1.00 31.02 H new ATOM 0 HE2 LYS A 98 10.106 -62.009 -12.070 1.00 2.21 H new ATOM 0 HE3 LYS A 98 11.573 -61.164 -11.616 1.00 2.21 H new ATOM 0 HZ1 LYS A 98 11.768 -60.769 -13.783 1.00 75.23 H new ATOM 0 HZ2 LYS A 98 12.285 -62.380 -13.930 1.00 75.23 H new ATOM 0 HZ3 LYS A 98 10.660 -61.979 -14.218 1.00 75.23 H new ATOM 1480 N SER A 99 10.171 -68.107 -10.504 1.00 22.33 N ATOM 1481 CA SER A 99 8.887 -68.802 -10.449 1.00 33.13 C ATOM 1482 C SER A 99 8.505 -69.107 -8.999 1.00 51.15 C ATOM 1483 O SER A 99 9.233 -68.745 -8.066 1.00 65.20 O ATOM 1484 CB SER A 99 8.971 -70.100 -11.269 1.00 24.15 C ATOM 1485 OG SER A 99 7.709 -70.735 -11.372 1.00 42.35 O ATOM 0 H SER A 99 10.977 -68.730 -10.543 1.00 22.33 H new ATOM 0 HA SER A 99 8.115 -68.161 -10.874 1.00 33.13 H new ATOM 0 HB2 SER A 99 9.349 -69.877 -12.267 1.00 24.15 H new ATOM 0 HB3 SER A 99 9.684 -70.780 -10.803 1.00 24.15 H new ATOM 0 HG SER A 99 7.043 -70.089 -11.688 1.00 42.35 H new ATOM 1491 N VAL A 100 7.358 -69.759 -8.805 1.00 74.22 N ATOM 1492 CA VAL A 100 6.900 -70.135 -7.475 1.00 45.42 C ATOM 1493 C VAL A 100 6.679 -71.645 -7.402 1.00 51.00 C ATOM 1494 O VAL A 100 5.710 -72.165 -7.956 1.00 74.34 O ATOM 1495 CB VAL A 100 5.591 -69.398 -7.085 1.00 21.34 C ATOM 1496 CG1 VAL A 100 5.086 -69.867 -5.720 1.00 13.01 C ATOM 1497 CG2 VAL A 100 5.793 -67.881 -7.088 1.00 20.43 C ATOM 0 H VAL A 100 6.729 -70.037 -9.559 1.00 74.22 H new ATOM 0 HA VAL A 100 7.675 -69.841 -6.768 1.00 45.42 H new ATOM 0 HB VAL A 100 4.837 -69.643 -7.833 1.00 21.34 H new ATOM 0 HG11 VAL A 100 4.168 -69.336 -5.470 1.00 13.01 H new ATOM 0 HG12 VAL A 100 4.888 -70.938 -5.754 1.00 13.01 H new ATOM 0 HG13 VAL A 100 5.842 -69.662 -4.962 1.00 13.01 H new ATOM 0 HG21 VAL A 100 4.860 -67.389 -6.811 1.00 20.43 H new ATOM 0 HG22 VAL A 100 6.570 -67.616 -6.371 1.00 20.43 H new ATOM 0 HG23 VAL A 100 6.093 -67.556 -8.084 1.00 20.43 H new ATOM 1507 N VAL A 101 7.601 -72.340 -6.741 1.00 73.33 N ATOM 1508 CA VAL A 101 7.472 -73.773 -6.507 1.00 33.12 C ATOM 1509 C VAL A 101 6.814 -74.008 -5.148 1.00 14.21 C ATOM 1510 O VAL A 101 7.325 -73.572 -4.116 1.00 71.23 O ATOM 1511 CB VAL A 101 8.844 -74.499 -6.582 1.00 1.53 C ATOM 1512 CG1 VAL A 101 9.394 -74.448 -8.008 1.00 0.11 C ATOM 1513 CG2 VAL A 101 9.852 -73.902 -5.595 1.00 23.20 C ATOM 0 H VAL A 101 8.451 -71.929 -6.356 1.00 73.33 H new ATOM 0 HA VAL A 101 6.846 -74.192 -7.295 1.00 33.12 H new ATOM 0 HB VAL A 101 8.686 -75.540 -6.301 1.00 1.53 H new ATOM 0 HG11 VAL A 101 10.355 -74.960 -8.046 1.00 0.11 H new ATOM 0 HG12 VAL A 101 8.695 -74.938 -8.685 1.00 0.11 H new ATOM 0 HG13 VAL A 101 9.524 -73.409 -8.311 1.00 0.11 H new ATOM 0 HG21 VAL A 101 10.799 -74.435 -5.676 1.00 23.20 H new ATOM 0 HG22 VAL A 101 10.007 -72.848 -5.826 1.00 23.20 H new ATOM 0 HG23 VAL A 101 9.467 -73.998 -4.580 1.00 23.20 H new ATOM 1523 N LYS A 102 5.663 -74.670 -5.154 1.00 25.24 N ATOM 1524 CA LYS A 102 4.866 -74.819 -3.941 1.00 22.23 C ATOM 1525 C LYS A 102 5.278 -76.051 -3.137 1.00 52.51 C ATOM 1526 O LYS A 102 5.360 -75.996 -1.907 1.00 64.20 O ATOM 1527 CB LYS A 102 3.369 -74.880 -4.283 1.00 14.41 C ATOM 1528 CG LYS A 102 2.462 -74.995 -3.057 1.00 2.24 C ATOM 1529 CD LYS A 102 2.728 -73.872 -2.057 1.00 35.55 C ATOM 1530 CE LYS A 102 1.913 -74.037 -0.779 1.00 34.44 C ATOM 1531 NZ LYS A 102 2.285 -73.031 0.249 1.00 11.03 N ATOM 0 H LYS A 102 5.261 -75.111 -5.982 1.00 25.24 H new ATOM 0 HA LYS A 102 5.052 -73.943 -3.320 1.00 22.23 H new ATOM 0 HB2 LYS A 102 3.097 -73.985 -4.843 1.00 14.41 H new ATOM 0 HB3 LYS A 102 3.190 -75.733 -4.938 1.00 14.41 H new ATOM 0 HG2 LYS A 102 1.419 -74.965 -3.371 1.00 2.24 H new ATOM 0 HG3 LYS A 102 2.622 -75.959 -2.574 1.00 2.24 H new ATOM 0 HD2 LYS A 102 3.789 -73.851 -1.809 1.00 35.55 H new ATOM 0 HD3 LYS A 102 2.489 -72.913 -2.517 1.00 35.55 H new ATOM 0 HE2 LYS A 102 0.852 -73.944 -1.011 1.00 34.44 H new ATOM 0 HE3 LYS A 102 2.065 -75.039 -0.378 1.00 34.44 H new ATOM 0 HZ1 LYS A 102 1.709 -73.177 1.102 1.00 11.03 H new ATOM 0 HZ2 LYS A 102 3.291 -73.136 0.489 1.00 11.03 H new ATOM 0 HZ3 LYS A 102 2.116 -72.075 -0.124 1.00 11.03 H new ATOM 1545 N LYS A 103 5.540 -77.162 -3.818 1.00 12.03 N ATOM 1546 CA LYS A 103 5.891 -78.406 -3.132 1.00 72.44 C ATOM 1547 C LYS A 103 6.857 -79.246 -3.967 1.00 14.24 C ATOM 1548 O LYS A 103 6.669 -79.403 -5.176 1.00 53.50 O ATOM 1549 CB LYS A 103 4.619 -79.213 -2.830 1.00 61.22 C ATOM 1550 CG LYS A 103 4.869 -80.493 -2.038 1.00 3.35 C ATOM 1551 CD LYS A 103 3.587 -81.295 -1.800 1.00 22.31 C ATOM 1552 CE LYS A 103 3.026 -81.912 -3.082 1.00 15.43 C ATOM 1553 NZ LYS A 103 2.367 -80.915 -3.975 1.00 35.52 N ATOM 0 H LYS A 103 5.517 -77.229 -4.836 1.00 12.03 H new ATOM 0 HA LYS A 103 6.389 -78.149 -2.197 1.00 72.44 H new ATOM 0 HB2 LYS A 103 3.925 -78.583 -2.273 1.00 61.22 H new ATOM 0 HB3 LYS A 103 4.132 -79.469 -3.771 1.00 61.22 H new ATOM 0 HG2 LYS A 103 5.588 -81.113 -2.574 1.00 3.35 H new ATOM 0 HG3 LYS A 103 5.319 -80.240 -1.078 1.00 3.35 H new ATOM 0 HD2 LYS A 103 3.788 -82.087 -1.079 1.00 22.31 H new ATOM 0 HD3 LYS A 103 2.834 -80.644 -1.356 1.00 22.31 H new ATOM 0 HE2 LYS A 103 3.834 -82.400 -3.627 1.00 15.43 H new ATOM 0 HE3 LYS A 103 2.306 -82.687 -2.820 1.00 15.43 H new ATOM 0 HZ1 LYS A 103 1.464 -81.300 -4.318 1.00 35.52 H new ATOM 0 HZ2 LYS A 103 2.191 -80.037 -3.445 1.00 35.52 H new ATOM 0 HZ3 LYS A 103 2.986 -80.712 -4.785 1.00 35.52 H new ATOM 1567 N VAL A 104 7.888 -79.779 -3.314 1.00 20.25 N ATOM 1568 CA VAL A 104 8.856 -80.660 -3.968 1.00 63.52 C ATOM 1569 C VAL A 104 8.729 -82.089 -3.429 1.00 23.40 C ATOM 1570 O VAL A 104 8.454 -82.297 -2.248 1.00 41.12 O ATOM 1571 CB VAL A 104 10.308 -80.142 -3.774 1.00 12.25 C ATOM 1572 CG1 VAL A 104 10.671 -80.043 -2.292 1.00 24.45 C ATOM 1573 CG2 VAL A 104 11.313 -81.022 -4.522 1.00 13.11 C ATOM 0 H VAL A 104 8.076 -79.615 -2.325 1.00 20.25 H new ATOM 0 HA VAL A 104 8.636 -80.664 -5.036 1.00 63.52 H new ATOM 0 HB VAL A 104 10.356 -79.139 -4.197 1.00 12.25 H new ATOM 0 HG11 VAL A 104 11.693 -79.678 -2.191 1.00 24.45 H new ATOM 0 HG12 VAL A 104 9.989 -79.353 -1.796 1.00 24.45 H new ATOM 0 HG13 VAL A 104 10.591 -81.028 -1.831 1.00 24.45 H new ATOM 0 HG21 VAL A 104 12.320 -80.635 -4.368 1.00 13.11 H new ATOM 0 HG22 VAL A 104 11.254 -82.043 -4.144 1.00 13.11 H new ATOM 0 HG23 VAL A 104 11.081 -81.015 -5.587 1.00 13.11 H new ATOM 1583 N SER A 105 8.888 -83.067 -4.312 1.00 70.15 N ATOM 1584 CA SER A 105 8.811 -84.478 -3.951 1.00 14.10 C ATOM 1585 C SER A 105 9.916 -85.247 -4.668 1.00 74.04 C ATOM 1586 O SER A 105 10.198 -84.982 -5.837 1.00 24.02 O ATOM 1587 CB SER A 105 7.432 -85.040 -4.319 1.00 4.52 C ATOM 1588 OG SER A 105 6.406 -84.318 -3.656 1.00 72.03 O ATOM 0 H SER A 105 9.075 -82.904 -5.301 1.00 70.15 H new ATOM 0 HA SER A 105 8.948 -84.587 -2.875 1.00 14.10 H new ATOM 0 HB2 SER A 105 7.286 -84.983 -5.398 1.00 4.52 H new ATOM 0 HB3 SER A 105 7.378 -86.094 -4.046 1.00 4.52 H new ATOM 0 HG SER A 105 5.533 -84.689 -3.903 1.00 72.03 H new ATOM 1594 N ILE A 106 10.546 -86.182 -3.966 1.00 60.24 N ATOM 1595 CA ILE A 106 11.652 -86.953 -4.530 1.00 10.30 C ATOM 1596 C ILE A 106 11.377 -88.454 -4.381 1.00 61.14 C ATOM 1597 O ILE A 106 10.732 -88.876 -3.418 1.00 52.41 O ATOM 1598 CB ILE A 106 13.001 -86.606 -3.842 1.00 72.12 C ATOM 1599 CG1 ILE A 106 13.174 -85.083 -3.690 1.00 61.14 C ATOM 1600 CG2 ILE A 106 14.162 -87.186 -4.645 1.00 61.45 C ATOM 1601 CD1 ILE A 106 13.292 -84.334 -5.002 1.00 61.02 C ATOM 0 H ILE A 106 10.311 -86.426 -3.004 1.00 60.24 H new ATOM 0 HA ILE A 106 11.729 -86.693 -5.586 1.00 10.30 H new ATOM 0 HB ILE A 106 12.996 -87.047 -2.845 1.00 72.12 H new ATOM 0 HG12 ILE A 106 12.324 -84.686 -3.134 1.00 61.14 H new ATOM 0 HG13 ILE A 106 14.065 -84.888 -3.093 1.00 61.14 H new ATOM 0 HG21 ILE A 106 15.103 -86.938 -4.155 1.00 61.45 H new ATOM 0 HG22 ILE A 106 14.058 -88.269 -4.704 1.00 61.45 H new ATOM 0 HG23 ILE A 106 14.155 -86.766 -5.651 1.00 61.45 H new ATOM 0 HD11 ILE A 106 13.411 -83.269 -4.803 1.00 61.02 H new ATOM 0 HD12 ILE A 106 14.159 -84.699 -5.553 1.00 61.02 H new ATOM 0 HD13 ILE A 106 12.391 -84.494 -5.595 1.00 61.02 H new ATOM 1613 N HIS A 107 11.870 -89.257 -5.324 1.00 62.33 N ATOM 1614 CA HIS A 107 11.614 -90.700 -5.324 1.00 42.21 C ATOM 1615 C HIS A 107 12.927 -91.481 -5.444 1.00 3.14 C ATOM 1616 O HIS A 107 13.830 -91.086 -6.177 1.00 44.31 O ATOM 1617 CB HIS A 107 10.659 -91.063 -6.470 1.00 1.15 C ATOM 1618 CG HIS A 107 9.925 -92.361 -6.275 1.00 52.33 C ATOM 1619 ND1 HIS A 107 10.173 -93.491 -7.021 1.00 63.51 N ATOM 1620 CD2 HIS A 107 8.921 -92.690 -5.425 1.00 51.43 C ATOM 1621 CE1 HIS A 107 9.356 -94.456 -6.640 1.00 61.40 C ATOM 1622 NE2 HIS A 107 8.585 -93.996 -5.673 1.00 21.31 N ATOM 0 H HIS A 107 12.449 -88.934 -6.099 1.00 62.33 H new ATOM 0 HA HIS A 107 11.145 -90.973 -4.379 1.00 42.21 H new ATOM 0 HB2 HIS A 107 9.930 -90.261 -6.588 1.00 1.15 H new ATOM 0 HB3 HIS A 107 11.228 -91.116 -7.398 1.00 1.15 H new ATOM 0 HD1 HIS A 107 10.878 -93.571 -7.754 1.00 63.51 H new ATOM 0 HD2 HIS A 107 8.469 -92.042 -4.688 1.00 51.43 H new ATOM 0 HE1 HIS A 107 9.324 -95.454 -7.051 1.00 61.40 H new ATOM 1631 N ALA A 108 12.989 -92.608 -4.744 1.00 62.21 N ATOM 1632 CA ALA A 108 14.216 -93.399 -4.568 1.00 71.54 C ATOM 1633 C ALA A 108 14.642 -94.204 -5.810 1.00 51.20 C ATOM 1634 O ALA A 108 15.587 -94.993 -5.731 1.00 13.21 O ATOM 1635 CB ALA A 108 14.064 -94.322 -3.364 1.00 1.01 C ATOM 0 H ALA A 108 12.179 -93.010 -4.273 1.00 62.21 H new ATOM 0 HA ALA A 108 15.018 -92.679 -4.402 1.00 71.54 H new ATOM 0 HB1 ALA A 108 14.975 -94.907 -3.236 1.00 1.01 H new ATOM 0 HB2 ALA A 108 13.887 -93.726 -2.469 1.00 1.01 H new ATOM 0 HB3 ALA A 108 13.221 -94.994 -3.525 1.00 1.01 H new ATOM 1641 N SER A 109 13.960 -94.019 -6.941 1.00 22.12 N ATOM 1642 CA SER A 109 14.109 -94.918 -8.094 1.00 13.31 C ATOM 1643 C SER A 109 15.547 -94.959 -8.619 1.00 70.35 C ATOM 1644 O SER A 109 16.223 -93.936 -8.718 1.00 20.01 O ATOM 1645 CB SER A 109 13.186 -94.457 -9.226 1.00 75.32 C ATOM 1646 OG SER A 109 11.824 -94.548 -8.851 1.00 74.32 O ATOM 0 H SER A 109 13.299 -93.256 -7.087 1.00 22.12 H new ATOM 0 HA SER A 109 13.843 -95.920 -7.758 1.00 13.31 H new ATOM 0 HB2 SER A 109 13.423 -93.428 -9.494 1.00 75.32 H new ATOM 0 HB3 SER A 109 13.362 -95.066 -10.112 1.00 75.32 H new ATOM 0 HG SER A 109 11.273 -94.060 -9.498 1.00 74.32 H new ATOM 1652 N SER A 110 15.980 -96.175 -8.963 1.00 53.15 N ATOM 1653 CA SER A 110 17.353 -96.458 -9.371 1.00 44.34 C ATOM 1654 C SER A 110 17.684 -95.890 -10.761 1.00 21.33 C ATOM 1655 O SER A 110 16.827 -95.314 -11.439 1.00 40.12 O ATOM 1656 CB SER A 110 17.579 -97.977 -9.353 1.00 20.12 C ATOM 1657 OG SER A 110 17.197 -98.537 -8.102 1.00 61.20 O ATOM 0 H SER A 110 15.378 -96.998 -8.965 1.00 53.15 H new ATOM 0 HA SER A 110 18.020 -95.966 -8.663 1.00 44.34 H new ATOM 0 HB2 SER A 110 17.005 -98.443 -10.154 1.00 20.12 H new ATOM 0 HB3 SER A 110 18.630 -98.194 -9.546 1.00 20.12 H new ATOM 0 HG SER A 110 17.349 -99.505 -8.117 1.00 61.20 H new ATOM 1663 N ARG A 111 18.939 -96.090 -11.172 1.00 10.21 N ATOM 1664 CA ARG A 111 19.484 -95.528 -12.409 1.00 70.34 C ATOM 1665 C ARG A 111 18.703 -95.984 -13.647 1.00 33.55 C ATOM 1666 O ARG A 111 18.366 -97.162 -13.789 1.00 43.23 O ATOM 1667 CB ARG A 111 20.958 -95.935 -12.540 1.00 25.13 C ATOM 1668 CG ARG A 111 21.631 -95.482 -13.834 1.00 15.51 C ATOM 1669 CD ARG A 111 23.023 -96.086 -13.974 1.00 32.52 C ATOM 1670 NE ARG A 111 22.979 -97.547 -13.894 1.00 21.10 N ATOM 1671 CZ ARG A 111 24.041 -98.342 -14.009 1.00 63.31 C ATOM 1672 NH1 ARG A 111 25.245 -97.836 -14.242 1.00 42.52 N ATOM 1673 NH2 ARG A 111 23.889 -99.653 -13.894 1.00 12.12 N ATOM 0 H ARG A 111 19.611 -96.652 -10.650 1.00 10.21 H new ATOM 0 HA ARG A 111 19.394 -94.443 -12.354 1.00 70.34 H new ATOM 0 HB2 ARG A 111 21.511 -95.524 -11.695 1.00 25.13 H new ATOM 0 HB3 ARG A 111 21.029 -97.020 -12.470 1.00 25.13 H new ATOM 0 HG2 ARG A 111 21.018 -95.774 -14.687 1.00 15.51 H new ATOM 0 HG3 ARG A 111 21.701 -94.394 -13.849 1.00 15.51 H new ATOM 0 HD2 ARG A 111 23.458 -95.785 -14.927 1.00 32.52 H new ATOM 0 HD3 ARG A 111 23.672 -95.696 -13.190 1.00 32.52 H new ATOM 0 HE ARG A 111 22.072 -97.987 -13.739 1.00 21.10 H new ATOM 0 HH11 ARG A 111 25.365 -96.827 -14.335 1.00 42.52 H new ATOM 0 HH12 ARG A 111 26.051 -98.456 -14.328 1.00 42.52 H new ATOM 0 HH21 ARG A 111 22.964-100.046 -13.719 1.00 12.12 H new ATOM 0 HH22 ARG A 111 24.697-100.270 -13.981 1.00 12.12 H new ATOM 1687 N VAL A 112 18.437 -95.034 -14.541 1.00 42.33 N ATOM 1688 CA VAL A 112 17.744 -95.291 -15.807 1.00 22.53 C ATOM 1689 C VAL A 112 18.506 -94.639 -16.963 1.00 21.24 C ATOM 1690 O VAL A 112 19.514 -93.967 -16.741 1.00 51.15 O ATOM 1691 CB VAL A 112 16.291 -94.746 -15.778 1.00 42.34 C ATOM 1692 CG1 VAL A 112 15.453 -95.485 -14.734 1.00 12.25 C ATOM 1693 CG2 VAL A 112 16.287 -93.238 -15.514 1.00 12.43 C ATOM 0 H VAL A 112 18.697 -94.057 -14.409 1.00 42.33 H new ATOM 0 HA VAL A 112 17.705 -96.371 -15.951 1.00 22.53 H new ATOM 0 HB VAL A 112 15.841 -94.922 -16.755 1.00 42.34 H new ATOM 0 HG11 VAL A 112 14.439 -95.086 -14.732 1.00 12.25 H new ATOM 0 HG12 VAL A 112 15.424 -96.547 -14.976 1.00 12.25 H new ATOM 0 HG13 VAL A 112 15.898 -95.350 -13.748 1.00 12.25 H new ATOM 0 HG21 VAL A 112 15.260 -92.874 -15.497 1.00 12.43 H new ATOM 0 HG22 VAL A 112 16.759 -93.036 -14.553 1.00 12.43 H new ATOM 0 HG23 VAL A 112 16.839 -92.729 -16.304 1.00 12.43 H new ATOM 1703 N ASP A 113 18.049 -94.852 -18.192 1.00 71.41 N ATOM 1704 CA ASP A 113 18.660 -94.208 -19.358 1.00 61.45 C ATOM 1705 C ASP A 113 18.134 -92.781 -19.502 1.00 54.52 C ATOM 1706 O ASP A 113 16.922 -92.561 -19.507 1.00 71.24 O ATOM 1707 CB ASP A 113 18.388 -95.016 -20.635 1.00 13.55 C ATOM 1708 CG ASP A 113 18.923 -94.342 -21.895 1.00 74.32 C ATOM 1709 OD1 ASP A 113 20.154 -94.133 -21.994 1.00 52.52 O ATOM 1710 OD2 ASP A 113 18.116 -94.028 -22.802 1.00 41.05 O ATOM 0 H ASP A 113 17.261 -95.462 -18.410 1.00 71.41 H new ATOM 0 HA ASP A 113 19.739 -94.172 -19.208 1.00 61.45 H new ATOM 0 HB2 ASP A 113 18.842 -96.002 -20.537 1.00 13.55 H new ATOM 0 HB3 ASP A 113 17.314 -95.168 -20.740 1.00 13.55 H new ATOM 1715 N ALA A 114 19.051 -91.823 -19.589 1.00 61.52 N ATOM 1716 CA ALA A 114 18.699 -90.406 -19.672 1.00 14.04 C ATOM 1717 C ALA A 114 17.923 -90.089 -20.953 1.00 42.21 C ATOM 1718 O ALA A 114 18.148 -90.704 -22.000 1.00 32.43 O ATOM 1719 CB ALA A 114 19.959 -89.553 -19.589 1.00 51.25 C ATOM 0 H ALA A 114 20.055 -92.003 -19.604 1.00 61.52 H new ATOM 0 HA ALA A 114 18.048 -90.171 -18.830 1.00 14.04 H new ATOM 0 HB1 ALA A 114 19.689 -88.499 -19.651 1.00 51.25 H new ATOM 0 HB2 ALA A 114 20.465 -89.743 -18.642 1.00 51.25 H new ATOM 0 HB3 ALA A 114 20.625 -89.807 -20.414 1.00 51.25 H new ATOM 1725 N ASP A 115 17.023 -89.112 -20.862 1.00 54.31 N ATOM 1726 CA ASP A 115 16.168 -88.723 -21.986 1.00 31.20 C ATOM 1727 C ASP A 115 16.375 -87.249 -22.338 1.00 74.33 C ATOM 1728 O ASP A 115 16.469 -86.891 -23.515 1.00 33.11 O ATOM 1729 CB ASP A 115 14.693 -88.993 -21.641 1.00 63.02 C ATOM 1730 CG ASP A 115 13.723 -88.512 -22.716 1.00 34.15 C ATOM 1731 OD1 ASP A 115 13.354 -87.321 -22.701 1.00 60.54 O ATOM 1732 OD2 ASP A 115 13.305 -89.330 -23.559 1.00 71.54 O ATOM 0 H ASP A 115 16.865 -88.569 -20.013 1.00 54.31 H new ATOM 0 HA ASP A 115 16.442 -89.320 -22.856 1.00 31.20 H new ATOM 0 HB2 ASP A 115 14.553 -90.063 -21.488 1.00 63.02 H new ATOM 0 HB3 ASP A 115 14.452 -88.502 -20.698 1.00 63.02 H new ATOM 1737 N GLY A 116 16.447 -86.400 -21.312 1.00 25.12 N ATOM 1738 CA GLY A 116 16.650 -84.975 -21.524 1.00 51.02 C ATOM 1739 C GLY A 116 15.807 -84.119 -20.594 1.00 52.42 C ATOM 1740 O GLY A 116 14.659 -84.455 -20.295 1.00 24.24 O ATOM 0 H GLY A 116 16.368 -86.677 -20.333 1.00 25.12 H new ATOM 0 HA2 GLY A 116 17.703 -84.736 -21.376 1.00 51.02 H new ATOM 0 HA3 GLY A 116 16.409 -84.727 -22.558 1.00 51.02 H new ATOM 1744 N PHE A 117 16.377 -83.021 -20.114 1.00 5.24 N ATOM 1745 CA PHE A 117 15.642 -82.090 -19.264 1.00 2.31 C ATOM 1746 C PHE A 117 14.984 -81.020 -20.132 1.00 32.41 C ATOM 1747 O PHE A 117 15.681 -80.192 -20.724 1.00 0.02 O ATOM 1748 CB PHE A 117 16.593 -81.420 -18.259 1.00 64.33 C ATOM 1749 CG PHE A 117 17.394 -82.381 -17.409 1.00 64.31 C ATOM 1750 CD1 PHE A 117 18.637 -82.833 -17.830 1.00 52.42 C ATOM 1751 CD2 PHE A 117 16.910 -82.820 -16.186 1.00 54.12 C ATOM 1752 CE1 PHE A 117 19.377 -83.702 -17.051 1.00 24.34 C ATOM 1753 CE2 PHE A 117 17.648 -83.689 -15.403 1.00 3.23 C ATOM 1754 CZ PHE A 117 18.881 -84.131 -15.836 1.00 43.44 C ATOM 0 H PHE A 117 17.344 -82.753 -20.298 1.00 5.24 H new ATOM 0 HA PHE A 117 14.878 -82.641 -18.715 1.00 2.31 H new ATOM 0 HB2 PHE A 117 17.283 -80.778 -18.806 1.00 64.33 H new ATOM 0 HB3 PHE A 117 16.010 -80.775 -17.602 1.00 64.33 H new ATOM 0 HD1 PHE A 117 19.031 -82.501 -18.779 1.00 52.42 H new ATOM 0 HD2 PHE A 117 15.945 -82.479 -15.841 1.00 54.12 H new ATOM 0 HE1 PHE A 117 20.342 -84.045 -17.392 1.00 24.34 H new ATOM 0 HE2 PHE A 117 17.259 -84.022 -14.452 1.00 3.23 H new ATOM 0 HZ PHE A 117 19.457 -84.811 -15.226 1.00 43.44 H new ATOM 1764 N GLU A 118 13.655 -81.032 -20.205 1.00 33.04 N ATOM 1765 CA GLU A 118 12.922 -80.024 -20.965 1.00 23.02 C ATOM 1766 C GLU A 118 11.454 -80.004 -20.548 1.00 63.02 C ATOM 1767 O GLU A 118 10.786 -81.036 -20.542 1.00 13.12 O ATOM 1768 CB GLU A 118 13.052 -80.277 -22.476 1.00 70.42 C ATOM 1769 CG GLU A 118 12.612 -81.671 -22.914 1.00 51.04 C ATOM 1770 CD GLU A 118 12.683 -81.867 -24.420 1.00 53.34 C ATOM 1771 OE1 GLU A 118 11.836 -81.295 -25.137 1.00 71.34 O ATOM 1772 OE2 GLU A 118 13.573 -82.603 -24.899 1.00 62.15 O ATOM 0 H GLU A 118 13.065 -81.727 -19.748 1.00 33.04 H new ATOM 0 HA GLU A 118 13.357 -79.049 -20.746 1.00 23.02 H new ATOM 0 HB2 GLU A 118 12.458 -79.536 -23.010 1.00 70.42 H new ATOM 0 HB3 GLU A 118 14.090 -80.126 -22.771 1.00 70.42 H new ATOM 0 HG2 GLU A 118 13.241 -82.415 -22.426 1.00 51.04 H new ATOM 0 HG3 GLU A 118 11.590 -81.847 -22.577 1.00 51.04 H new ATOM 1779 N ILE A 119 10.951 -78.830 -20.197 1.00 14.51 N ATOM 1780 CA ILE A 119 9.570 -78.701 -19.756 1.00 51.30 C ATOM 1781 C ILE A 119 8.618 -79.002 -20.918 1.00 62.21 C ATOM 1782 O ILE A 119 8.217 -78.112 -21.673 1.00 44.42 O ATOM 1783 CB ILE A 119 9.278 -77.304 -19.129 1.00 2.53 C ATOM 1784 CG1 ILE A 119 9.992 -77.155 -17.765 1.00 24.02 C ATOM 1785 CG2 ILE A 119 7.774 -77.087 -18.956 1.00 53.12 C ATOM 1786 CD1 ILE A 119 11.508 -77.197 -17.828 1.00 71.13 C ATOM 0 H ILE A 119 11.476 -77.956 -20.209 1.00 14.51 H new ATOM 0 HA ILE A 119 9.402 -79.433 -18.966 1.00 51.30 H new ATOM 0 HB ILE A 119 9.663 -76.546 -19.812 1.00 2.53 H new ATOM 0 HG12 ILE A 119 9.688 -76.211 -17.314 1.00 24.02 H new ATOM 0 HG13 ILE A 119 9.648 -77.950 -17.103 1.00 24.02 H new ATOM 0 HG21 ILE A 119 7.596 -76.105 -18.517 1.00 53.12 H new ATOM 0 HG22 ILE A 119 7.284 -77.144 -19.928 1.00 53.12 H new ATOM 0 HG23 ILE A 119 7.368 -77.857 -18.300 1.00 53.12 H new ATOM 0 HD11 ILE A 119 11.917 -77.085 -16.824 1.00 71.13 H new ATOM 0 HD12 ILE A 119 11.828 -78.151 -18.246 1.00 71.13 H new ATOM 0 HD13 ILE A 119 11.869 -76.385 -18.460 1.00 71.13 H new ATOM 1798 N ARG A 120 8.322 -80.286 -21.075 1.00 2.03 N ATOM 1799 CA ARG A 120 7.409 -80.777 -22.099 1.00 61.44 C ATOM 1800 C ARG A 120 5.968 -80.621 -21.655 1.00 32.31 C ATOM 1801 O ARG A 120 5.659 -80.763 -20.473 1.00 1.25 O ATOM 1802 CB ARG A 120 7.708 -82.250 -22.405 1.00 4.12 C ATOM 1803 CG ARG A 120 8.894 -82.446 -23.332 1.00 2.23 C ATOM 1804 CD ARG A 120 9.223 -83.923 -23.529 1.00 30.01 C ATOM 1805 NE ARG A 120 10.563 -84.110 -24.090 1.00 3.51 N ATOM 1806 CZ ARG A 120 11.382 -85.116 -23.762 1.00 12.41 C ATOM 1807 NH1 ARG A 120 10.961 -86.093 -22.966 1.00 3.32 N ATOM 1808 NH2 ARG A 120 12.623 -85.151 -24.233 1.00 2.32 N ATOM 0 H ARG A 120 8.713 -81.023 -20.489 1.00 2.03 H new ATOM 0 HA ARG A 120 7.556 -80.186 -23.003 1.00 61.44 H new ATOM 0 HB2 ARG A 120 7.897 -82.776 -21.469 1.00 4.12 H new ATOM 0 HB3 ARG A 120 6.826 -82.706 -22.855 1.00 4.12 H new ATOM 0 HG2 ARG A 120 8.679 -81.990 -24.298 1.00 2.23 H new ATOM 0 HG3 ARG A 120 9.764 -81.932 -22.923 1.00 2.23 H new ATOM 0 HD2 ARG A 120 9.153 -84.442 -22.573 1.00 30.01 H new ATOM 0 HD3 ARG A 120 8.485 -84.375 -24.192 1.00 30.01 H new ATOM 0 HE ARG A 120 10.893 -83.430 -24.775 1.00 3.51 H new ATOM 0 HH11 ARG A 120 10.009 -86.079 -22.601 1.00 3.32 H new ATOM 0 HH12 ARG A 120 11.590 -86.857 -22.720 1.00 3.32 H new ATOM 0 HH21 ARG A 120 12.956 -84.409 -24.848 1.00 2.32 H new ATOM 0 HH22 ARG A 120 13.243 -85.920 -23.980 1.00 2.32 H new ATOM 1822 N ARG A 121 5.099 -80.315 -22.608 1.00 14.01 N ATOM 1823 CA ARG A 121 3.674 -80.162 -22.337 1.00 75.33 C ATOM 1824 C ARG A 121 2.887 -81.153 -23.193 1.00 64.21 C ATOM 1825 O ARG A 121 2.613 -82.272 -22.715 1.00 51.44 O ATOM 1826 CB ARG A 121 3.201 -78.726 -22.627 1.00 72.42 C ATOM 1827 CG ARG A 121 3.987 -77.638 -21.896 1.00 14.51 C ATOM 1828 CD ARG A 121 3.376 -76.257 -22.132 1.00 12.45 C ATOM 1829 NE ARG A 121 4.254 -75.171 -21.675 1.00 4.53 N ATOM 1830 CZ ARG A 121 3.851 -74.124 -20.949 1.00 42.14 C ATOM 1831 NH1 ARG A 121 2.591 -74.037 -20.533 1.00 1.44 N ATOM 1832 NH2 ARG A 121 4.717 -73.161 -20.647 1.00 65.01 N ATOM 1833 OXT ARG A 121 2.586 -80.822 -24.362 1.00 0.00 O ATOM 0 H ARG A 121 5.357 -80.167 -23.584 1.00 14.01 H new ATOM 0 HA ARG A 121 3.499 -80.365 -21.280 1.00 75.33 H new ATOM 0 HB2 ARG A 121 3.267 -78.545 -23.700 1.00 72.42 H new ATOM 0 HB3 ARG A 121 2.149 -78.642 -22.354 1.00 72.42 H new ATOM 0 HG2 ARG A 121 4.002 -77.853 -20.828 1.00 14.51 H new ATOM 0 HG3 ARG A 121 5.022 -77.643 -22.237 1.00 14.51 H new ATOM 0 HD2 ARG A 121 3.169 -76.131 -23.195 1.00 12.45 H new ATOM 0 HD3 ARG A 121 2.420 -76.192 -21.612 1.00 12.45 H new ATOM 0 HE ARG A 121 5.240 -75.220 -21.930 1.00 4.53 H new ATOM 0 HH11 ARG A 121 1.925 -74.773 -20.768 1.00 1.44 H new ATOM 0 HH12 ARG A 121 2.291 -73.235 -19.979 1.00 1.44 H new ATOM 0 HH21 ARG A 121 5.683 -73.224 -20.969 1.00 65.01 H new ATOM 0 HH22 ARG A 121 4.415 -72.359 -20.093 1.00 65.01 H new TER 1847 ARG A 121